data_2rpq_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2rpq _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 m170 . . . . . 0 N--CA 1.433 -1.317 0 CA-C-O 121.77 0.795 . . . . 1.0 112.609 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.403 ' HB ' ' HA ' ' A' ' 80' ' ' ASP . 22.9 pt -143.03 160.72 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 C-N-CA 131.29 3.836 . . . . 1.0 106.541 -174.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -116.05 144.85 43.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.769 -2.457 . . . . 1.0 110.566 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -132.25 157.2 44.97 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 119.375 -2.078 . . . . 1.0 106.084 173.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -122.25 150.0 42.91 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 120.009 -1.682 . . . . 1.0 110.456 168.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.46 126.05 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.01 130.21 53.1 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 122.876 1.322 . . . . 1.0 112.114 -176.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.505 0 CA-C-O 123.351 1.528 . . . . 1.0 115.133 178.61 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.436 -1.13 0 N-CA-C 112.782 0.66 . . . . 1.0 112.782 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.19 138.78 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.067 0 O-C-N 120.566 -1.334 . . . . 1.0 110.178 170.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.07 158.49 16.39 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 123.406 1.574 . . . . 1.0 112.687 174.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -145.03 152.49 40.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.725 -1.125 . . . . 1.0 108.099 -173.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -124.12 118.3 26.6 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.768 -1.568 . . . . 1.0 106.768 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.412 ' CG1' ' H ' ' A' ' 35' ' ' LYS . 12.7 tt -144.49 154.83 14.84 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 C-N-CA 128.247 2.619 . . . . 1.0 111.113 -154.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.412 ' H ' ' CG1' ' A' ' 34' ' ' ILE . 1.5 mppt? -102.09 157.11 17.12 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 112.054 -2.339 . . . . 1.0 112.118 -177.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.09 -37.97 78.73 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 115.816 1.784 . . . . 1.0 115.816 -158.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -82.77 -17.97 42.32 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 114.344 1.238 . . . . 1.0 114.344 176.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 31.9 m -61.59 131.75 92.8 Favored Pre-proline 0 N--CA 1.438 -1.032 0 C-N-CA 125.479 1.511 . . . . 1.0 112.148 -175.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.78 157.08 62.96 Favored 'Trans proline' 0 N--CA 1.441 -1.606 0 CA-C-N 124.881 2.779 . . . . 1.0 114.914 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.433 2.7 pp -61.98 -25.55 67.69 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 124.958 1.303 . . . . 1.0 114.484 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.0 p -52.67 -29.02 24.2 Favored 'General case' 0 N--CA 1.435 -1.218 0 O-C-N 119.803 -1.811 . . . . 1.0 114.897 171.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -44.17 65.43 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 119.754 -1.841 . . . . 1.0 111.521 -175.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -35.58 80.0 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.898 -1.126 . . . . 1.0 111.957 175.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 ttm -61.65 -42.09 98.42 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 119.778 -1.826 . . . . 1.0 114.11 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 ttpt -69.14 -37.17 78.15 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.147 -1.595 . . . . 1.0 112.503 175.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.65 83.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 114.238 1.199 . . . . 1.0 114.238 171.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -59.13 -43.31 91.97 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.911 -1.743 . . . . 1.0 111.897 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 81.2 m -62.53 -42.46 99.54 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 125.009 1.323 . . . . 1.0 113.769 175.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.14 -48.89 78.08 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 124.594 1.157 . . . . 1.0 113.754 175.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -78.57 -43.16 27.25 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 114.85 1.426 . . . . 1.0 114.85 -174.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -114.16 9.59 17.18 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.934 -1.104 . . . . 1.0 112.793 -165.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.08 46.99 8.75 Favored Glycine 0 CA--C 1.493 -1.281 0 N-CA-C 117.67 1.828 . . . . 1.0 117.67 161.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.7 mt -125.59 160.95 28.32 Favored 'General case' 0 N--CA 1.436 -1.167 0 C-N-CA 124.566 1.147 . . . . 1.0 109.825 -170.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 m -102.28 133.81 46.59 Favored 'General case' 0 CA--C 1.496 -1.118 0 O-C-N 120.295 -1.503 . . . . 1.0 110.218 172.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -63.74 -32.59 74.13 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 116.527 2.047 . . . . 1.0 116.527 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -78.99 -14.71 59.04 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.19 -1.569 . . . . 1.0 114.024 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -87.73 -16.83 33.14 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.882 -1.136 . . . . 1.0 112.616 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.1 pt -116.37 140.47 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 O-C-N 120.814 -1.179 . . . . 1.0 108.987 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -138.21 146.33 42.49 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 107.265 -1.383 . . . . 1.0 107.265 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.1 m-30 -107.15 148.58 28.66 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.505 1.145 . . . . 1.0 110.663 -170.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -131.98 153.95 49.81 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 124.844 1.258 . . . . 1.0 109.346 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -126.12 108.69 11.57 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 165.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 48.71 50.49 17.21 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.098 2.159 . . . . 1.0 115.371 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.62 6.57 89.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 116.186 1.234 . . . . 1.0 116.186 -177.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -110.62 127.67 26.58 Favored Pre-proline 0 N--CA 1.435 -1.199 0 CA-C-N 119.564 1.682 . . . . 1.0 109.411 176.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -56.13 135.23 68.84 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 123.237 2.624 . . . . 1.0 115.54 166.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.4 pt -119.29 137.6 52.69 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 106.236 -1.764 . . . . 1.0 106.236 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -112.67 163.83 14.08 Favored 'General case' 0 N--CA 1.435 -1.206 0 O-C-N 120.717 -1.239 . . . . 1.0 108.433 -162.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -61.44 -28.3 69.17 Favored 'General case' 0 CA--C 1.497 -1.092 0 O-C-N 118.98 -2.325 . . . . 1.0 115.731 -175.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.1 m -78.51 -13.93 59.6 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 126.086 1.754 . . . . 1.0 112.459 175.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -75.89 168.93 19.12 Favored 'General case' 0 N--CA 1.432 -1.357 0 O-C-N 119.627 -1.92 . . . . 1.0 111.363 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p -151.43 161.72 28.83 Favored Pre-proline 0 CA--C 1.497 -1.081 0 O-C-N 119.878 -1.764 . . . . 1.0 111.047 -154.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -60.4 -31.69 92.98 Favored 'Trans proline' 0 N--CA 1.44 -1.649 0 C-N-CA 123.6 2.867 . . . . 1.0 115.417 168.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.87 -45.5 70.85 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 122.508 1.147 . . . . 1.0 112.65 173.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -70.48 -42.81 70.89 Favored 'General case' 0 N--CA 1.433 -1.295 0 C-N-CA 125.501 1.521 . . . . 1.0 113.729 -177.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 25.9 tp -85.82 -8.46 58.08 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.557 -1.339 . . . . 1.0 113.008 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 67.39 42.63 2.15 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.549 1.539 . . . . 1.0 113.608 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 63.9 mtt -62.3 148.73 44.11 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 127.065 2.146 . . . . 1.0 115.184 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -91.53 176.48 6.53 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.472 1.509 . . . . 1.0 111.431 -178.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' A' ' 18' ' ' ILE 0.259 12.1 p-10 -58.16 -26.39 62.66 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.437 2.295 . . . . 1.0 114.477 168.049 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -138.26 79.15 1.72 Allowed 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 125.35 1.46 . . . . 1.0 109.686 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.68 162.44 21.82 Favored 'General case' 0 N--CA 1.437 -1.094 0 O-C-N 120.021 -1.674 . . . . 1.0 112.483 176.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.8 m -131.21 118.57 20.62 Favored 'General case' 0 CA--C 1.496 -1.11 0 C-N-CA 124.297 1.039 . . . . 1.0 110.332 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mm -119.18 140.6 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 C-N-CA 126.828 2.051 . . . . 1.0 108.937 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -111.05 149.45 30.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.281 -1.512 . . . . 1.0 110.989 -170.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.0 t -115.76 139.63 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 O-C-N 120.665 -1.272 . . . . 1.0 110.625 -174.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -121.63 142.87 49.7 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.426 -0.953 . . . . 1.0 108.426 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -89.56 120.29 30.73 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 120.864 -1.147 . . . . 1.0 109.216 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 . . . . . 0 N--CA 1.435 -1.213 0 N-CA-C 114.822 1.415 . . . . 1.0 114.822 -154.874 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.481 0.3 OUTLIER . . . . . 0 N--CA 1.434 -1.252 0 N-CA-C 112.635 0.606 . . . . 1.0 112.635 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.9 mt -88.82 116.61 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 O-C-N 119.857 -1.777 . . . . 1.0 113.259 -163.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -102.17 109.24 20.88 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 118.903 -2.373 . . . . 1.0 109.132 160.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . 0.412 HD12 ' HB ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.053 0 O-C-N 119.651 -1.906 . . . . 1.0 114.389 -168.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 m80 . . . . . 0 N--CA 1.431 -1.417 0 CA-C-O 122.67 1.224 . . . . 1.0 109.271 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.7 pt -139.38 160.7 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 126.461 1.904 . . . . 1.0 107.282 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -117.7 144.73 44.98 Favored 'General case' 0 N--CA 1.432 -1.329 0 N-CA-C 106.092 -1.818 . . . . 1.0 106.092 170.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.7 156.06 45.56 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 105.256 -2.128 . . . . 1.0 105.256 168.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -115.72 150.61 36.55 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 125.786 1.635 . . . . 1.0 109.91 169.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -111.28 127.59 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.675 0 N-CA-C 105.719 -1.956 . . . . 1.0 105.719 171.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -130.3 130.15 44.14 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.163 0.982 . . . . 1.0 111.581 -174.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.395 0 N-CA-C 108.548 -1.821 . . . . 1.0 108.548 172.782 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.437 -1.115 0 N-CA-C 112.273 0.472 . . . . 1.0 112.273 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.258 0.4 OUTLIER -129.25 138.8 53.45 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.083 0 O-C-N 119.636 -1.915 . . . . 1.0 110.531 158.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.06 139.54 53.18 Favored 'General case' 0 CA--C 1.494 -1.202 0 CA-C-O 123.425 1.583 . . . . 1.0 113.479 175.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.472 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.1 OUTLIER -144.06 146.86 33.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.745 -1.222 . . . . 1.0 112.963 -165.339 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.269 20.5 ttpt -112.78 115.85 29.15 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.858 1.263 . . . . 1.0 113.371 -166.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.9 154.67 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 123.576 1.655 . . . . 1.0 110.878 -152.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -106.63 165.72 11.09 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 123.298 1.523 . . . . 1.0 114.217 -170.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -62.97 -38.17 90.04 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.193 2.294 . . . . 1.0 117.193 -159.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.28 15.88 21.58 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.536 -1.353 . . . . 1.0 113.764 -178.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 16.1 m -84.08 135.93 41.58 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 124.855 1.262 . . . . 1.0 111.723 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.13 152.6 76.19 Favored 'Trans proline' 0 N--CA 1.441 -1.571 0 C-N-CA 123.039 2.492 . . . . 1.0 114.576 173.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.332 3.4 pp -61.88 -25.69 67.7 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 114.405 1.261 . . . . 1.0 114.405 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 83.7 p -52.72 -29.06 24.81 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 119.538 -1.976 . . . . 1.0 116.067 166.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -74.55 -45.88 42.68 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 119.557 -1.965 . . . . 1.0 110.618 -167.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.451 ' H ' HD11 ' A' ' 43' ' ' LEU 0.327 0.0 OUTLIER -68.85 -31.13 69.86 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.695 1.368 . . . . 1.0 114.695 170.233 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 18.4 ttt -61.04 -41.72 97.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.397 -2.065 . . . . 1.0 114.065 173.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -41.52 98.65 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 120.876 -1.14 . . . . 1.0 112.418 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.61 -36.84 81.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.118 1.525 . . . . 1.0 115.118 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -58.94 -43.86 91.28 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 120.025 -1.672 . . . . 1.0 112.185 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.2 m -62.3 -42.36 99.3 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.009 1.324 . . . . 1.0 113.02 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -67.19 -51.52 52.51 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 113.464 0.913 . . . . 1.0 113.464 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.7 -40.68 72.72 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 115.067 1.506 . . . . 1.0 115.067 -174.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -111.13 9.82 21.94 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.915 -1.116 . . . . 1.0 112.513 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.34 Favored Glycine 0 CA--C 1.493 -1.303 0 N-CA-C 115.871 1.108 . . . . 1.0 115.871 164.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.3 mt -116.92 160.41 20.95 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.73 -0.865 . . . . 1.0 111.725 -169.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.0 m -102.23 134.5 45.41 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 121.073 -1.017 . . . . 1.0 109.071 175.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 tpp -61.4 -37.91 85.16 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 127.276 2.23 . . . . 1.0 114.08 -165.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -95.82 1.38 53.12 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.481 -0.781 . . . . 1.0 112.072 -176.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -102.15 -3.98 26.58 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.342 1.057 . . . . 1.0 111.694 177.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.9 pt -123.33 146.12 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 124.471 1.108 . . . . 1.0 108.991 168.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -138.26 148.78 45.07 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 120.65 -1.281 . . . . 1.0 107.682 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -103.32 147.54 26.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 122.757 1.265 . . . . 1.0 111.854 -176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -131.19 161.19 32.74 Favored 'General case' 0 N--CA 1.433 -1.317 0 C-N-CA 125.809 1.643 . . . . 1.0 108.135 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -138.57 124.12 19.58 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 107.615 -1.254 . . . . 1.0 107.615 165.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.4 t0 58.54 32.53 22.23 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.591 1.556 . . . . 1.0 114.859 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.42 8.47 87.53 Favored Glycine 0 N--CA 1.435 -1.382 0 O-C-N 119.953 -1.717 . . . . 1.0 116.104 -173.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -117.14 142.14 29.58 Favored Pre-proline 0 N--CA 1.434 -1.234 0 CA-C-N 119.028 1.414 . . . . 1.0 108.481 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -74.7 142.4 28.82 Favored 'Trans proline' 0 C--N 1.307 -1.617 0 CA-C-N 123.286 2.209 . . . . 1.0 112.271 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 pt -116.83 143.84 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 N-CA-C 106.571 -1.64 . . . . 1.0 106.571 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -89.52 154.69 19.81 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 119.592 -1.943 . . . . 1.0 109.815 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -61.06 -27.71 68.54 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 118.845 -2.409 . . . . 1.0 115.217 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 m -95.51 5.64 51.02 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 124.218 1.007 . . . . 1.0 111.758 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -74.56 174.89 8.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.256 -2.153 . . . . 1.0 110.36 165.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.9 p -150.41 163.29 24.73 Favored Pre-proline 0 CA--C 1.498 -1.028 0 O-C-N 119.375 -2.078 . . . . 1.0 112.556 -153.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -57.48 -33.86 97.07 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 123.857 3.038 . . . . 1.0 116.253 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.8 -44.75 69.42 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 122.499 1.143 . . . . 1.0 113.027 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.51 -43.96 79.61 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 124.839 1.255 . . . . 1.0 113.334 -178.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.3 tp -90.83 -8.42 49.62 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.901 -1.124 . . . . 1.0 112.58 -178.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 62.29 44.96 7.09 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 126.794 2.038 . . . . 1.0 114.532 -178.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.6 mtt -59.41 151.32 24.11 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 127.074 2.149 . . . . 1.0 112.868 171.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -120.58 177.76 4.94 Favored 'General case' 0 N--CA 1.432 -1.333 0 O-C-N 121.213 -0.93 . . . . 1.0 109.073 -170.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -56.74 -26.77 57.94 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 127.695 2.398 . . . . 1.0 115.426 -175.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -136.07 83.21 1.99 Allowed 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 123.872 0.869 . . . . 1.0 109.101 162.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.4 166.36 19.48 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 120.121 -1.612 . . . . 1.0 114.581 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 m -132.58 118.42 19.18 Favored 'General case' 0 CA--C 1.496 -1.13 0 C-N-CA 124.503 1.121 . . . . 1.0 110.925 173.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.7 mm -108.64 140.94 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 C-N-CA 129.502 3.121 . . . . 1.0 109.595 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -110.83 134.33 52.61 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 119.465 -2.022 . . . . 1.0 107.615 -164.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 t -110.95 126.71 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-O 121.643 0.735 . . . . 1.0 109.339 -173.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -116.43 143.08 46.02 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-O 122.201 1.0 . . . . 1.0 110.836 170.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -88.16 139.82 30.11 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.547 -1.346 . . . . 1.0 112.703 -175.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.434 -1.233 0 C-N-CA 124.385 1.074 . . . . 1.0 109.769 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 12.4 t . . . . . 0 N--CA 1.436 -1.162 0 CA-C-O 124.023 1.868 . . . . 1.0 111.57 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . 0.472 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 8.4 mt -113.13 124.81 70.14 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.27 0 C-N-CA 127.327 2.251 . . . . 1.0 111.13 -168.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -102.1 125.41 48.78 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 106.424 -1.695 . . . . 1.0 106.424 163.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.5 -0.951 0 N-CA-C 119.298 3.073 . . . . 1.0 119.298 -157.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.437 -1.119 0 N-CA-C 116.176 1.917 . . . . 1.0 116.176 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 37.0 pt -138.86 160.74 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 126.145 1.778 . . . . 1.0 108.556 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -117.76 144.91 44.87 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 119.179 -2.201 . . . . 1.0 108.035 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -127.43 157.09 40.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 119.219 -2.175 . . . . 1.0 105.433 169.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -120.41 150.6 40.53 Favored 'General case' 0 N--CA 1.432 -1.369 0 O-C-N 119.498 -2.001 . . . . 1.0 111.482 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -118.44 122.1 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 N-CA-C 106.023 -1.843 . . . . 1.0 106.023 177.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.13 131.64 54.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.543 1.137 . . . . 1.0 111.631 -169.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.45 0 N-CA-C 109.465 -1.454 . . . . 1.0 109.465 177.034 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.433 -1.279 0 N-CA-C 111.563 0.209 . . . . 1.0 111.563 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.256 0.5 OUTLIER -129.14 138.68 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 O-C-N 120.355 -1.466 . . . . 1.0 110.88 168.35 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.01 144.98 46.23 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 124.911 2.291 . . . . 1.0 113.963 -175.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -132.96 140.66 47.92 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.806 -1.809 . . . . 1.0 107.338 -165.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -108.47 118.51 36.96 Favored 'General case' 0 N--CA 1.434 -1.258 0 C-N-CA 126.415 1.886 . . . . 1.0 111.78 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 9.2 tt -147.91 154.73 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.351 0 CA-C-O 124.954 2.311 . . . . 1.0 110.646 -148.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -117.27 160.29 21.33 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 112.511 -2.131 . . . . 1.0 111.84 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -62.15 -38.13 87.83 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 117.4 2.37 . . . . 1.0 117.4 -159.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -74.49 -25.14 59.19 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.346 -1.471 . . . . 1.0 114.36 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.7 m -62.69 127.76 90.79 Favored Pre-proline 0 N--CA 1.436 -1.134 0 C-N-CA 125.885 1.674 . . . . 1.0 114.5 -172.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -69.81 158.47 56.79 Favored 'Trans proline' 0 N--CA 1.441 -1.582 0 C-N-CA 122.895 2.397 . . . . 1.0 113.986 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.439 2.8 pp -59.34 -25.48 64.24 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 114.565 1.32 . . . . 1.0 114.565 177.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 t -52.71 -29.03 24.55 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 120.154 -1.592 . . . . 1.0 113.738 171.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -43.28 88.38 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 119.959 -1.713 . . . . 1.0 113.24 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.421 0.0 OUTLIER -70.31 -31.22 68.45 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 171.169 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.6 tpp -60.22 -45.92 91.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 O-C-N 120.466 -1.396 . . . . 1.0 113.132 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -43.88 98.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 120.909 -1.12 . . . . 1.0 112.552 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.22 79.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.07 1.137 . . . . 1.0 114.07 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -62.7 -44.16 96.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 120.395 -1.44 . . . . 1.0 111.781 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.0 m -62.93 -41.86 99.62 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.731 1.213 . . . . 1.0 114.095 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -68.19 -51.32 47.02 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.984 -1.697 . . . . 1.0 114.868 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.63 -43.17 63.6 Favored 'General case' 0 CA--C 1.496 -1.116 0 O-C-N 120.049 -1.657 . . . . 1.0 113.749 -173.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -112.46 6.97 18.89 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 123.84 0.856 . . . . 1.0 113.036 -170.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.63 3.04 89.86 Favored Glycine 0 N--CA 1.437 -1.247 0 N-CA-C 118.631 2.212 . . . . 1.0 118.631 162.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.18 166.46 23.21 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.746 1.758 . . . . 1.0 115.746 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.1 m -102.25 129.42 48.65 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.549 -1.344 . . . . 1.0 110.455 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -66.55 -21.24 66.16 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 115.681 1.734 . . . . 1.0 115.681 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ptt-85 -77.85 -17.88 56.89 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.75 -1.219 . . . . 1.0 113.462 176.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -94.79 -16.82 22.68 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.392 1.077 . . . . 1.0 112.353 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.5 pt -119.98 141.2 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.2 0 C-N-CA 124.647 1.179 . . . . 1.0 110.251 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 154.94 49.04 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 107.001 -1.481 . . . . 1.0 107.001 171.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -113.2 148.67 34.99 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 122.302 1.049 . . . . 1.0 110.98 -171.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 41.2 ptt180 -137.51 158.15 45.01 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.753 -1.217 . . . . 1.0 111.525 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -137.52 121.2 17.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.51 -0.922 . . . . 1.0 108.51 174.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t70 56.4 40.35 29.74 Favored 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 126.223 1.809 . . . . 1.0 112.99 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.52 3.43 86.48 Favored Glycine 0 N--CA 1.438 -1.205 0 O-C-N 120.095 -1.628 . . . . 1.0 116.273 -176.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -116.65 139.76 25.93 Favored Pre-proline 0 N--CA 1.435 -1.189 0 CA-C-N 119.548 1.674 . . . . 1.0 110.493 -172.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.65 142.64 32.74 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.78 2.32 . . . . 1.0 112.84 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 pt -117.82 147.07 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 C-N-CA 125.439 1.496 . . . . 1.0 108.849 -178.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -109.18 160.58 15.97 Favored 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 120.755 -1.216 . . . . 1.0 110.849 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -69.84 -14.28 62.67 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 119.157 -2.214 . . . . 1.0 114.969 -177.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 95.8 m -99.34 0.46 42.95 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 124.849 1.26 . . . . 1.0 111.714 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -76.75 168.95 19.19 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 118.275 -2.766 . . . . 1.0 109.87 161.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 p -152.77 163.62 22.94 Favored Pre-proline 0 CA--C 1.497 -1.09 0 O-C-N 119.69 -1.881 . . . . 1.0 111.035 -155.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -58.4 -32.87 97.19 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 123.516 2.811 . . . . 1.0 115.781 167.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.82 -45.96 55.66 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 122.123 0.963 . . . . 1.0 112.57 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -66.86 -40.66 87.95 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 125.676 1.591 . . . . 1.0 113.423 -176.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -88.24 -8.34 55.41 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 121.123 -0.986 . . . . 1.0 112.272 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 62.88 48.21 4.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 126.501 1.92 . . . . 1.0 113.65 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.4 mtt -61.19 154.2 23.99 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.727 2.011 . . . . 1.0 112.792 170.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -114.26 -178.4 3.36 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 -172.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.39 10.2 p-10 -55.05 -26.61 38.69 Favored 'General case' 0 N--CA 1.435 -1.225 0 N-CA-C 116.654 2.094 . . . . 1.0 116.654 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -141.27 73.04 1.4 Allowed 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 125.469 1.508 . . . . 1.0 110.27 174.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.19 164.9 24.54 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 116.077 1.881 . . . . 1.0 116.077 -174.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.1 m -131.77 115.39 15.91 Favored 'General case' 0 CA--C 1.495 -1.149 0 C-N-CA 124.439 1.096 . . . . 1.0 111.361 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.4 mm -117.9 140.68 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 C-N-CA 126.84 2.056 . . . . 1.0 108.745 -175.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.92 145.7 37.87 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.139 -1.601 . . . . 1.0 110.02 -166.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.6 t -108.56 135.21 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 124.297 1.039 . . . . 1.0 109.014 -177.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -121.83 136.35 54.93 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 122.678 1.228 . . . . 1.0 109.637 164.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -87.93 132.56 34.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 124.268 1.027 . . . . 1.0 110.413 -173.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 96.8 mm-40 . . . . . 0 N--CA 1.433 -1.278 0 N-CA-C 115.593 1.701 . . . . 1.0 115.593 -168.802 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.434 -1.26 0 N-CA-C 113.964 1.098 . . . . 1.0 113.964 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.7 mt -112.43 116.32 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-O 121.993 0.901 . . . . 1.0 109.715 -169.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.07 103.68 14.27 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 120.463 -1.398 . . . . 1.0 108.803 174.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.071 0 O-C-N 119.731 -1.856 . . . . 1.0 115.077 -171.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 p80 . . . . . 0 N--CA 1.431 -1.414 0 CA-C-O 122.454 1.121 . . . . 1.0 112.64 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.8 pt -133.4 160.74 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.296 0 C-N-CA 129.47 3.108 . . . . 1.0 106.173 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.0 m-20 -113.12 144.81 42.01 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 118.885 -2.385 . . . . 1.0 108.185 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -128.37 155.91 43.95 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 105.967 -1.864 . . . . 1.0 105.967 171.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -123.87 150.6 44.42 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 120.495 -1.378 . . . . 1.0 111.968 172.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -118.93 119.25 60.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.178 0 N-CA-C 108.038 -1.097 . . . . 1.0 108.038 177.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.44 130.22 54.23 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 122.389 1.09 . . . . 1.0 113.268 -165.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.523 0 CA-C-O 122.882 1.268 . . . . 1.0 111.991 173.732 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 p . . . . . 0 N--CA 1.428 -1.546 0 N-CA-C 106.715 -1.587 . . . . 1.0 106.715 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -121.4 133.34 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 O-C-N 120.931 -1.105 . . . . 1.0 109.027 170.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.48 ' O ' ' HB ' ' B' ' 966' ' ' VAL . 0.0 OUTLIER -99.3 160.84 13.98 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.54 3.067 . . . . 1.0 114.583 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -145.1 140.54 28.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.297 -2.127 . . . . 1.0 105.526 -175.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -100.22 117.77 35.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 C-N-CA 127.317 2.247 . . . . 1.0 107.657 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.434 HG13 ' H ' ' A' ' 35' ' ' LYS . 12.3 tt -146.1 154.87 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.281 0 C-N-CA 127.937 2.495 . . . . 1.0 111.33 -151.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' H ' HG13 ' A' ' 34' ' ' ILE . 0.0 OUTLIER -122.73 167.54 13.34 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 113.595 -1.638 . . . . 1.0 113.705 -174.265 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -66.57 -38.21 86.59 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 116.989 2.218 . . . . 1.0 116.989 -162.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -87.11 -27.78 22.9 Favored 'General case' 0 CA--C 1.494 -1.175 0 O-C-N 120.2 -1.562 . . . . 1.0 111.226 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.6 m -57.75 111.99 4.19 Favored Pre-proline 0 N--CA 1.436 -1.13 0 C-N-CA 127.834 2.454 . . . . 1.0 113.686 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -67.47 163.19 35.75 Favored 'Trans proline' 0 N--CA 1.441 -1.607 0 C-N-CA 124.055 3.17 . . . . 1.0 116.081 -172.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.45 2.5 pp -64.74 -25.59 68.0 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.087 1.514 . . . . 1.0 115.087 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 97.3 p -52.68 -29.1 24.68 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.876 -1.765 . . . . 1.0 114.915 168.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.18 -43.92 80.96 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.214 -1.554 . . . . 1.0 112.094 -177.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.4 -35.59 77.88 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.555 -1.341 . . . . 1.0 113.568 171.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.3 ttm -60.59 -43.65 97.14 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.318 -1.488 . . . . 1.0 114.207 176.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -66.72 -39.44 88.02 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.517 -1.364 . . . . 1.0 112.971 174.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.91 82.66 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.249 -1.532 . . . . 1.0 114.392 177.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -58.54 -43.85 89.39 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 126.542 1.937 . . . . 1.0 110.863 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.9 m -62.01 -41.75 98.42 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 120.332 -1.48 . . . . 1.0 114.055 174.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -67.15 -47.71 70.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 114.707 1.373 . . . . 1.0 114.707 175.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -73.14 -43.25 61.89 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 115.892 1.812 . . . . 1.0 115.892 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -112.49 4.17 17.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 121.611 -0.68 . . . . 1.0 112.051 -164.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.49 24.37 47.03 Favored Glycine 0 CA--C 1.494 -1.272 0 N-CA-C 117.403 1.721 . . . . 1.0 117.403 159.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.3 mt -103.7 166.88 10.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 124.773 1.229 . . . . 1.0 112.733 -171.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.9 m -101.91 133.19 47.07 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 120.552 -1.342 . . . . 1.0 110.08 171.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 20.5 ptp -66.45 -25.42 66.72 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 115.499 1.666 . . . . 1.0 115.499 -170.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 -87.05 -1.62 58.01 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.281 -1.512 . . . . 1.0 112.783 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -102.82 -4.73 24.47 Favored 'General case' 0 N--CA 1.433 -1.297 0 O-C-N 120.893 -1.129 . . . . 1.0 111.792 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.6 pt -118.95 142.37 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 O-C-N 120.69 -1.256 . . . . 1.0 111.326 175.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -138.16 143.85 40.48 Favored 'General case' 0 N--CA 1.434 -1.268 0 O-C-N 120.246 -1.534 . . . . 1.0 107.542 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -105.65 145.16 31.39 Favored 'General case' 0 N--CA 1.433 -1.318 0 O-C-N 121.102 -0.999 . . . . 1.0 109.346 -175.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -120.84 152.61 38.18 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.462 1.125 . . . . 1.0 109.838 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -127.99 119.23 25.05 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.261 -1.755 . . . . 1.0 106.261 162.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.8 t70 52.68 45.99 27.59 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.075 1.35 . . . . 1.0 113.615 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.73 3.92 87.58 Favored Glycine 0 N--CA 1.435 -1.406 0 N-CA-C 117.823 1.889 . . . . 1.0 117.823 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -121.38 144.63 40.47 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 120.762 2.281 . . . . 1.0 109.039 176.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -68.04 149.65 77.17 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 122.785 2.03 . . . . 1.0 113.701 176.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.9 pt -116.84 141.97 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.258 0 N-CA-C 106.012 -1.847 . . . . 1.0 106.012 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -112.64 171.26 7.63 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 120.481 -1.387 . . . . 1.0 109.842 -162.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -73.53 -16.77 61.27 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.428 -2.045 . . . . 1.0 113.131 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.7 m -83.54 -13.88 53.51 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 125.15 1.38 . . . . 1.0 112.436 167.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -77.36 167.37 21.8 Favored 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.087 -2.258 . . . . 1.0 111.208 168.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.0 p -154.78 160.4 30.95 Favored Pre-proline 0 CA--C 1.496 -1.103 0 O-C-N 120.057 -1.652 . . . . 1.0 109.873 -160.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.1 -41.17 26.91 Favored 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 124.352 3.368 . . . . 1.0 116.328 161.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.09 88.1 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 114.489 1.292 . . . . 1.0 114.489 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -71.42 -38.4 71.4 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.323 1.449 . . . . 1.0 113.014 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 tp -94.57 -1.93 52.43 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 121.088 -1.008 . . . . 1.0 112.905 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 55.29 48.22 19.74 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 126.495 1.918 . . . . 1.0 114.915 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.6 mtt -62.2 144.12 55.89 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 126.136 1.774 . . . . 1.0 113.758 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -92.49 176.33 6.5 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 122.354 1.073 . . . . 1.0 112.473 -174.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.258 9.3 p-10 -56.57 -26.52 55.44 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 127.832 2.453 . . . . 1.0 115.144 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -138.39 75.36 1.52 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 125.185 1.394 . . . . 1.0 108.123 166.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.76 157.22 31.79 Favored 'General case' 0 N--CA 1.436 -1.145 0 O-C-N 119.668 -1.895 . . . . 1.0 113.696 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.9 m -125.62 115.25 19.84 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.905 0.86 . . . . 1.0 110.314 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.3 mm -122.02 140.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.172 0 C-N-CA 127.548 2.339 . . . . 1.0 108.747 -172.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -110.91 147.02 35.52 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.855 -1.778 . . . . 1.0 109.578 -163.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 59.8 t -108.53 129.33 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.22 0 O-C-N 121.002 -1.062 . . . . 1.0 109.865 -175.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -118.71 138.88 52.33 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 122.97 1.367 . . . . 1.0 110.701 163.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -87.19 142.37 27.96 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 121.15 -0.969 . . . . 1.0 112.764 -175.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.433 -1.315 0 O-C-N 121.199 -0.938 . . . . 1.0 110.785 -169.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 31' ' ' GLN . 31.1 t . . . . . 0 N--CA 1.436 -1.173 0 CA-C-O 122.035 0.922 . . . . 1.0 113.199 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 1.2 mt -94.41 123.94 46.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 O-C-N 121.053 -1.029 . . . . 1.0 108.501 -159.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -101.98 107.1 18.13 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.183 -1.573 . . . . 1.0 107.033 172.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 N--CA 1.437 -1.077 0 O-C-N 120.219 -1.55 . . . . 1.0 112.824 -172.379 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.43 -1.432 0 CA-C-O 122.45 1.119 . . . . 1.0 113.098 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.6 pt -136.37 160.63 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 C-N-CA 128.53 2.732 . . . . 1.0 106.343 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -117.66 144.7 44.96 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 119.641 -1.912 . . . . 1.0 106.589 169.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.47 154.55 51.35 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.392 -1.443 . . . . 1.0 107.142 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -120.0 148.23 43.81 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.071 1.748 . . . . 1.0 111.354 175.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 t -119.98 122.93 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 N-CA-C 107.783 -1.192 . . . . 1.0 107.783 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.57 130.17 55.01 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 124.615 1.166 . . . . 1.0 111.883 -172.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.294 0 CA-C-O 122.746 1.192 . . . . 1.0 114.756 -177.658 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.436 -1.16 0 N-CA-C 113.421 0.897 . . . . 1.0 113.421 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -129.26 138.73 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.862 -1.774 . . . . 1.0 110.169 169.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.69 145.88 47.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-O 124.06 1.885 . . . . 1.0 113.77 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.83 141.7 44.73 Favored 'General case' 0 N--CA 1.432 -1.353 0 O-C-N 119.81 -1.806 . . . . 1.0 109.254 -166.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.272 26.7 ttpt -107.05 115.89 30.97 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.552 1.941 . . . . 1.0 113.483 -176.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 6.8 tt -148.86 154.62 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.429 0 CA-C-O 123.994 1.854 . . . . 1.0 109.833 -158.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.305 3.7 mppt? -95.89 165.76 12.12 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.316 -1.765 . . . . 1.0 112.48 -172.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.4 mtm180 -63.49 -38.07 89.72 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 115.847 1.795 . . . . 1.0 115.847 -160.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -85.43 -23.97 27.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.549 -1.344 . . . . 1.0 112.742 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.8 m -59.12 131.79 87.29 Favored Pre-proline 0 N--CA 1.436 -1.148 0 C-N-CA 126.972 2.109 . . . . 1.0 115.062 -169.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.02 162.05 41.61 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 124.097 3.198 . . . . 1.0 115.236 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.384 2.7 pp -66.91 -25.69 66.5 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 124.663 1.185 . . . . 1.0 114.178 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.4 p -52.74 -29.17 25.63 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 120.342 -1.474 . . . . 1.0 114.839 170.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.73 -43.53 65.69 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.212 -1.555 . . . . 1.0 112.32 -172.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.359 0.0 OUTLIER -68.09 -31.13 70.53 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.61 -1.306 . . . . 1.0 114.167 168.624 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 9.7 ttt -61.64 -43.43 98.88 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.535 -1.353 . . . . 1.0 114.001 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -67.47 -36.41 81.1 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 120.41 -1.431 . . . . 1.0 113.554 170.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.51 -34.89 77.78 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 119.411 -2.056 . . . . 1.0 114.323 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.6 -43.06 99.56 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 126.296 1.839 . . . . 1.0 111.914 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 75.4 m -61.51 -43.85 98.13 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.614 -1.304 . . . . 1.0 113.834 171.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -62.35 -51.84 66.02 Favored 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 120.6 -1.313 . . . . 1.0 114.442 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.47 -43.33 27.39 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 115.132 1.53 . . . . 1.0 115.132 -176.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -108.77 4.22 23.43 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 121.206 -0.933 . . . . 1.0 111.448 -166.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.01 4.95 89.74 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 117.896 1.919 . . . . 1.0 117.896 161.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.7 mt -76.63 160.95 28.96 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.742 1.617 . . . . 1.0 113.833 -173.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 m -102.27 131.77 48.63 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 120.426 -1.421 . . . . 1.0 109.138 168.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.9 ptp -66.58 -18.54 65.42 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 116.427 2.01 . . . . 1.0 116.427 -173.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -85.61 -8.92 57.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 120.602 -1.312 . . . . 1.0 114.078 173.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -82.07 -33.25 29.96 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.634 -1.916 . . . . 1.0 112.453 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.6 pt -113.59 152.68 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 C-N-CA 125.279 1.431 . . . . 1.0 111.119 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -137.69 154.92 49.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 O-C-N 120.511 -1.368 . . . . 1.0 108.055 172.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 -111.3 148.56 32.66 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.662 1.22 . . . . 1.0 110.553 -173.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 53.3 mtm180 -130.26 159.28 37.36 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 122.165 0.983 . . . . 1.0 109.454 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -133.8 125.71 29.05 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 163.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 48.35 44.79 20.35 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 126.816 2.046 . . . . 1.0 114.416 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.98 6.83 86.32 Favored Glycine 0 N--CA 1.435 -1.424 0 O-C-N 120.146 -1.596 . . . . 1.0 116.785 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -119.94 148.28 46.27 Favored Pre-proline 0 N--CA 1.436 -1.13 0 CA-C-N 121.14 2.47 . . . . 1.0 109.288 175.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.11 149.72 52.73 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 122.588 2.192 . . . . 1.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.1 pt -120.57 140.41 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 N-CA-C 107.166 -1.42 . . . . 1.0 107.166 174.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.51 164.28 11.75 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.759 -1.213 . . . . 1.0 110.957 -168.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.9 -13.89 60.59 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 119.056 -2.277 . . . . 1.0 113.945 -176.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 m -96.7 1.45 51.01 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 124.6 1.16 . . . . 1.0 111.226 170.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -82.5 172.0 13.5 Favored 'General case' 0 N--CA 1.432 -1.325 0 O-C-N 119.098 -2.251 . . . . 1.0 110.211 171.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.5 p -147.98 162.19 32.02 Favored Pre-proline 0 CA--C 1.498 -1.053 0 O-C-N 119.684 -1.885 . . . . 1.0 112.384 -153.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -56.17 -33.62 90.95 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 123.587 2.858 . . . . 1.0 115.879 166.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.88 -45.96 69.63 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 119.573 1.078 . . . . 1.0 113.541 176.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.26 -38.64 71.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 125.638 1.575 . . . . 1.0 113.63 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -93.27 -8.47 42.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 121.014 -1.053 . . . . 1.0 111.669 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 63.87 43.22 5.51 Favored 'General case' 0 N--CA 1.435 -1.219 0 C-N-CA 126.878 2.071 . . . . 1.0 113.763 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.2 147.0 49.18 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.216 1.807 . . . . 1.0 111.825 175.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -120.41 176.33 5.54 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 108.712 -0.847 . . . . 1.0 108.712 -168.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.276 10.7 p-10 -54.79 -26.54 35.32 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.837 2.055 . . . . 1.0 115.272 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.07 77.19 1.69 Allowed 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.582 1.553 . . . . 1.0 110.073 166.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.69 160.91 22.29 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 119.656 -1.903 . . . . 1.0 114.823 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -133.59 115.57 14.85 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 124.808 1.243 . . . . 1.0 111.059 -178.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.6 mm -120.4 140.72 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.027 0 C-N-CA 127.817 2.447 . . . . 1.0 111.049 -171.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -110.86 137.41 48.55 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.92 -1.738 . . . . 1.0 109.907 -162.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.65 132.21 57.19 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.246 0 O-C-N 120.774 -1.204 . . . . 1.0 109.63 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -120.4 137.3 54.39 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-O 123.135 1.445 . . . . 1.0 110.223 159.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -96.85 120.4 37.11 Favored 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 120.671 -1.268 . . . . 1.0 110.357 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 . . . . . 0 N--CA 1.434 -1.268 0 O-C-N 121.124 -0.985 . . . . 1.0 111.831 -174.12 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.295 0.2 OUTLIER . . . . . 0 N--CA 1.436 -1.156 0 N-CA-C 115.234 1.568 . . . . 1.0 115.234 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 6.3 mt -113.12 115.42 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 124.113 0.965 . . . . 1.0 109.699 -171.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -102.15 101.98 12.37 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.715 1.606 . . . . 1.0 110.897 172.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.439 -0.988 0 N-CA-C 118.922 2.934 . . . . 1.0 118.922 -168.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.4 p-80 . . . . . 0 N--CA 1.435 -1.181 0 N-CA-C 117.272 2.323 . . . . 1.0 117.272 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.2 pt -133.26 160.82 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.3 0 C-N-CA 128.732 2.813 . . . . 1.0 107.38 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -110.09 144.92 37.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 O-C-N 118.988 -2.32 . . . . 1.0 108.441 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.4 HD21 HG23 ' A' ' 34' ' ' ILE . 1.5 pt? -127.13 149.79 49.79 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.678 -1.889 . . . . 1.0 106.384 169.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -117.71 148.83 41.64 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 119.74 -1.85 . . . . 1.0 110.629 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.4 t -117.3 127.95 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.271 0 N-CA-C 107.127 -1.434 . . . . 1.0 107.127 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.69 130.13 55.67 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.2 1.0 . . . . 1.0 110.323 176.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.427 0 CA-C-O 123.093 1.385 . . . . 1.0 114.096 178.291 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 N--CA 1.437 -1.108 0 CA-C-O 121.502 0.668 . . . . 1.0 112.611 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.24 138.82 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.947 -1.72 . . . . 1.0 112.174 173.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.45 147.95 34.16 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-O 125.052 2.358 . . . . 1.0 115.488 175.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -132.95 140.62 47.91 Favored 'General case' 0 N--CA 1.432 -1.365 0 O-C-N 119.523 -1.985 . . . . 1.0 107.862 -170.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -104.56 118.96 37.88 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 126.318 1.847 . . . . 1.0 109.368 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.4 HG23 HD21 ' A' ' 20' ' ' LEU . 12.8 tt -148.46 154.81 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.317 0 CA-C-O 125.238 2.447 . . . . 1.0 111.537 -151.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -104.97 160.35 15.1 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 112.844 -1.98 . . . . 1.0 112.201 -176.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -61.74 -38.08 86.64 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 116.198 1.925 . . . . 1.0 116.198 -166.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -98.52 -9.8 24.45 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 119.982 -1.698 . . . . 1.0 113.654 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 88.9 m -62.05 121.68 67.29 Favored Pre-proline 0 N--CA 1.437 -1.101 0 C-N-CA 125.047 1.339 . . . . 1.0 111.402 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.59 160.23 44.53 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 CA-C-N 123.926 2.438 . . . . 1.0 114.309 -168.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.466 1.5 pp -61.45 -25.59 67.32 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 114.914 1.45 . . . . 1.0 114.914 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 99.0 p -52.77 -29.02 24.98 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.206 -1.559 . . . . 1.0 115.165 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.59 -46.98 67.91 Favored 'General case' 0 N--CA 1.437 -1.098 0 O-C-N 120.974 -1.079 . . . . 1.0 111.924 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.64 -31.5 70.69 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.667 -1.271 . . . . 1.0 112.914 174.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.6 ttp -59.82 -44.99 93.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.316 -1.49 . . . . 1.0 114.369 175.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -66.33 -38.44 87.68 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.778 -1.201 . . . . 1.0 112.697 174.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.96 -37.96 89.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 114.263 1.209 . . . . 1.0 114.263 174.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.01 -43.27 99.14 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 126.066 1.747 . . . . 1.0 111.902 174.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.3 m -62.17 -44.71 96.0 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.882 -1.136 . . . . 1.0 113.454 174.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -66.3 -49.52 66.78 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 114.17 1.174 . . . . 1.0 114.17 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -71.14 -43.29 67.87 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.04 -1.662 . . . . 1.0 115.285 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -115.32 6.35 14.88 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 121.077 -1.015 . . . . 1.0 112.929 -163.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.02 9.26 84.56 Favored Glycine 0 CA--C 1.493 -1.308 0 N-CA-C 117.153 1.621 . . . . 1.0 117.153 162.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.89 159.63 23.62 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.553 -1.557 . . . . 1.0 112.32 -175.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.3 m -102.33 134.02 46.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 O-C-N 121.1 -1.0 . . . . 1.0 110.146 172.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.7 ptp -66.26 -30.75 71.24 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 115.935 1.828 . . . . 1.0 115.935 -167.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt-85 -78.38 -15.04 59.1 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.348 -1.47 . . . . 1.0 113.455 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -92.07 -12.66 32.48 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.399 1.08 . . . . 1.0 111.756 -174.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -119.71 143.68 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.201 0 C-N-CA 124.34 1.056 . . . . 1.0 109.16 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -137.81 154.94 49.49 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.642 -1.286 . . . . 1.0 108.118 172.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -114.22 140.43 48.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 107.991 -1.115 . . . . 1.0 107.991 -162.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -129.67 149.54 51.38 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 120.822 -1.174 . . . . 1.0 109.191 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -123.53 112.31 17.32 Favored 'General case' 0 N--CA 1.433 -1.301 0 N-CA-C 107.81 -1.182 . . . . 1.0 107.81 160.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.6 t0 56.67 45.15 22.52 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 125.557 1.543 . . . . 1.0 113.974 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.94 1.44 84.88 Favored Glycine 0 N--CA 1.436 -1.309 0 N-CA-C 116.267 1.267 . . . . 1.0 116.267 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.61 125.81 31.87 Favored Pre-proline 0 N--CA 1.435 -1.223 0 CA-C-N 119.243 1.521 . . . . 1.0 108.994 -174.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -54.54 135.28 65.83 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.641 2.894 . . . . 1.0 115.79 169.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.8 pt -119.57 143.01 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -112.25 166.61 11.12 Favored 'General case' 0 CA--C 1.494 -1.2 0 O-C-N 120.407 -1.433 . . . . 1.0 110.995 -164.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -65.74 -21.49 66.52 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 119.825 -1.797 . . . . 1.0 114.755 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.1 m -82.89 -15.57 50.92 Favored 'General case' 0 N--CA 1.437 -1.109 0 C-N-CA 125.147 1.379 . . . . 1.0 112.959 171.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.8 168.75 19.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.217 -2.177 . . . . 1.0 112.637 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.1 p -148.63 158.81 39.65 Favored Pre-proline 0 CA--C 1.497 -1.08 0 O-C-N 120.179 -1.575 . . . . 1.0 110.68 -157.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -59.72 -30.91 93.25 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.18 2.586 . . . . 1.0 115.523 171.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.53 -46.03 74.01 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-O 122.035 0.921 . . . . 1.0 113.434 174.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -71.11 -42.56 69.13 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.717 1.207 . . . . 1.0 113.906 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.54 -8.54 58.88 Favored 'General case' 0 N--CA 1.435 -1.21 0 O-C-N 121.19 -0.944 . . . . 1.0 111.233 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 63.21 48.24 3.76 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 126.584 1.954 . . . . 1.0 112.983 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -64.67 148.55 50.77 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 127.201 2.201 . . . . 1.0 112.997 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -101.52 176.89 5.08 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 124.423 1.089 . . . . 1.0 110.069 -173.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.417 14.0 p-10 -60.48 -26.64 66.95 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 116.689 2.107 . . . . 1.0 116.689 -175.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -135.16 90.94 2.68 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.918 1.287 . . . . 1.0 108.442 157.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.51 163.57 22.59 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.845 -1.159 . . . . 1.0 114.013 -174.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.1 m -130.75 115.24 16.38 Favored 'General case' 0 CA--C 1.496 -1.098 0 O-C-N 121.307 -0.871 . . . . 1.0 110.337 177.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 47.1 mm -120.12 140.72 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 128.395 2.678 . . . . 1.0 109.452 -171.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -110.86 138.32 47.41 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 119.987 -1.696 . . . . 1.0 108.547 -164.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -115.56 133.53 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-O 122.789 1.28 . . . . 1.0 110.169 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -116.18 138.72 51.03 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 125.057 1.343 . . . . 1.0 110.218 169.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -89.11 137.21 32.53 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.884 -1.135 . . . . 1.0 111.874 -173.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 . . . . . 0 N--CA 1.435 -1.212 0 C-N-CA 125.499 1.52 . . . . 1.0 110.5 -178.851 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.277 0.2 OUTLIER . . . . . 0 CA--C 1.494 -1.18 0 N-CA-C 114.504 1.298 . . . . 1.0 114.504 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.2 mt -112.5 118.59 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 N-CA-C 108.39 -0.967 . . . . 1.0 108.39 -173.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -102.14 108.35 19.72 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 119.982 -1.698 . . . . 1.0 108.857 166.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 N--CA 1.437 -1.101 0 O-C-N 119.766 -1.834 . . . . 1.0 113.471 -170.559 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 . . . . . 0 N--CA 1.428 -1.541 0 N-CA-C 115.464 1.653 . . . . 1.0 115.464 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.5 pt -143.02 160.83 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 C-N-CA 130.917 3.687 . . . . 1.0 105.991 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -113.74 144.81 42.34 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 118.21 -2.806 . . . . 1.0 107.55 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.417 HD21 ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -133.8 156.6 47.73 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 119.327 -2.108 . . . . 1.0 105.975 173.801 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.38 150.64 50.65 Favored 'General case' 0 N--CA 1.434 -1.26 0 O-C-N 119.809 -1.807 . . . . 1.0 112.524 171.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.1 t -113.02 129.15 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.921 -1.511 . . . . 1.0 106.921 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 136.37 54.88 Favored 'General case' 0 N--CA 1.433 -1.324 0 C-N-CA 124.504 1.122 . . . . 1.0 112.453 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.494 -1.277 0 O-C-N 121.06 -1.025 . . . . 1.0 114.719 170.416 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t . . . . . 0 N--CA 1.434 -1.235 0 N-CA-C 107.421 -1.326 . . . . 1.0 107.421 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.1 p -129.16 138.02 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.101 0 O-C-N 121.325 -0.86 . . . . 1.0 111.204 174.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.486 ' O ' ' HB ' ' B' ' 966' ' ' VAL . 0.0 OUTLIER -100.98 160.07 14.68 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.829 3.204 . . . . 1.0 115.821 171.817 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -141.92 140.65 32.86 Favored 'General case' 0 N--CA 1.427 -1.61 0 O-C-N 118.954 -2.341 . . . . 1.0 105.174 -175.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.3 ttpt -101.39 117.32 34.7 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.336 -1.477 . . . . 1.0 107.618 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 6.4 tt -138.54 154.83 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-O 123.903 1.811 . . . . 1.0 110.09 -151.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -121.91 159.33 27.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.595 -1.639 . . . . 1.0 111.417 -177.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -71.23 -18.68 62.44 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 117.21 2.3 . . . . 1.0 117.21 -164.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 50.0 m80 -81.75 -28.64 33.22 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.925 -1.734 . . . . 1.0 112.481 167.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.4 m -66.88 116.16 32.45 Favored Pre-proline 0 N--CA 1.437 -1.088 0 N-CA-C 114.654 1.353 . . . . 1.0 114.654 -166.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.42 161.78 44.51 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 123.477 2.785 . . . . 1.0 115.099 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.454 3.0 pp -64.9 -25.63 67.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 114.582 1.327 . . . . 1.0 114.582 -178.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.5 p -52.85 -29.26 27.01 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 115.326 1.602 . . . . 1.0 115.326 167.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.19 -46.82 54.69 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.246 -1.534 . . . . 1.0 111.785 -171.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.507 ' H ' HD11 ' A' ' 43' ' ' LEU 0.337 0.0 OUTLIER -70.18 -31.29 68.69 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 113.995 1.109 . . . . 1.0 113.995 174.21 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.7 ttm -59.74 -45.85 90.95 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.413 -1.429 . . . . 1.0 113.797 170.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -65.15 -38.22 89.91 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.426 -1.421 . . . . 1.0 113.669 171.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.82 82.03 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 119.994 -1.691 . . . . 1.0 114.219 176.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.59 -41.13 94.08 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.695 1.998 . . . . 1.0 110.677 171.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 67.3 m -64.11 -43.51 95.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 120.66 -1.275 . . . . 1.0 113.812 172.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.93 -51.0 62.43 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.384 -1.448 . . . . 1.0 114.295 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -72.63 -43.21 63.53 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.365 -1.459 . . . . 1.0 114.77 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -116.26 12.26 15.34 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 121.799 0.809 . . . . 1.0 112.185 -162.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.38 10.8 85.59 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.411 1.325 . . . . 1.0 116.411 160.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.0 mt -80.48 159.95 25.41 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 124.887 1.275 . . . . 1.0 113.321 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 74.6 m -102.27 130.6 49.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.977 -1.077 . . . . 1.0 110.812 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.7 tpt -59.89 -38.27 81.76 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 116.298 1.962 . . . . 1.0 116.298 -165.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -94.71 1.68 55.51 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 120.705 -1.247 . . . . 1.0 111.993 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 -102.17 -8.37 21.4 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 121.086 -1.008 . . . . 1.0 111.126 175.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 pt -116.83 138.12 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.215 0 O-C-N 120.483 -1.386 . . . . 1.0 109.34 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -138.18 154.96 49.12 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 106.675 -1.602 . . . . 1.0 106.675 173.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -115.88 148.74 39.65 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.994 1.378 . . . . 1.0 111.077 -169.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.8 ptt180 -136.31 150.16 48.76 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 121.083 -1.011 . . . . 1.0 109.57 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -124.74 109.05 12.63 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.166 -1.79 . . . . 1.0 106.166 173.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . 0.435 38.3 m-20 59.67 -127.04 1.18 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-O 116.721 -1.609 . . . . 1.0 110.826 -144.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.25 -16.2 53.35 Favored Glycine 0 CA--C 1.495 -1.158 3 C-N-CA 138.983 7.944 . . . . 1.0 118.565 7.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -123.6 129.47 24.84 Favored Pre-proline 0 N--CA 1.435 -1.19 0 CA-C-N 120.11 1.955 . . . . 1.0 109.142 160.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.26 135.19 66.56 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.703 2.269 . . . . 1.0 113.048 156.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.6 pt -117.64 138.68 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.16 0 CA-C-O 122.142 0.972 . . . . 1.0 108.481 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -112.72 165.99 11.77 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 121.188 -0.945 . . . . 1.0 109.841 -162.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -71.7 -13.83 61.85 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.745 -1.847 . . . . 1.0 113.719 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.5 m -90.23 -7.42 53.56 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 126.295 1.838 . . . . 1.0 111.728 169.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -82.38 165.07 20.61 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 118.387 -2.695 . . . . 1.0 110.661 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.7 p -151.22 164.38 20.44 Favored Pre-proline 0 CA--C 1.498 -1.022 0 O-C-N 120.523 -1.361 . . . . 1.0 110.656 -154.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -60.3 -36.0 89.35 Favored 'Trans proline' 0 N--CA 1.441 -1.599 0 C-N-CA 123.044 2.496 . . . . 1.0 113.999 171.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.18 80.58 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-O 122.57 1.176 . . . . 1.0 112.574 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -68.77 -45.18 72.04 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.453 1.101 . . . . 1.0 113.376 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.8 tp -89.48 -8.4 52.96 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 121.061 -1.024 . . . . 1.0 112.781 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.26 33.0 mt-10 64.35 44.06 4.42 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 127.802 2.441 . . . . 1.0 115.663 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.7 mtt -57.11 154.24 10.31 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 129.17 2.988 . . . . 1.0 113.771 173.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -142.19 -176.23 4.74 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 106.793 -1.558 . . . . 1.0 106.793 -172.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.312 0.9 OUTLIER -53.16 -26.54 17.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.084 2.954 . . . . 1.0 118.628 -165.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -140.36 56.36 1.6 Allowed 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 124.784 1.234 . . . . 1.0 110.528 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.45 162.31 25.81 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 119.608 -1.933 . . . . 1.0 116.057 -174.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.2 m -131.72 118.98 20.7 Favored 'General case' 0 CA--C 1.497 -1.088 0 O-C-N 120.968 -1.082 . . . . 1.0 111.795 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.3 mt -119.27 140.7 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 C-N-CA 126.495 1.918 . . . . 1.0 108.995 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.95 137.38 48.65 Favored 'General case' 0 N--CA 1.434 -1.253 0 O-C-N 120.289 -1.507 . . . . 1.0 108.026 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.1 p -108.58 136.75 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.146 0 O-C-N 120.509 -1.369 . . . . 1.0 109.946 -177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -122.44 143.55 49.61 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.647 -1.283 . . . . 1.0 108.374 171.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -86.96 135.1 33.41 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.129 0.966 . . . . 1.0 112.15 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 . . . . . 0 N--CA 1.432 -1.333 0 C-N-CA 125.397 1.479 . . . . 1.0 109.675 -178.31 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . 0.486 ' HB ' ' O ' ' A' ' 31' ' ' GLN . 9.5 t . . . . . 0 N--CA 1.437 -1.084 0 CA-C-O 121.663 0.744 . . . . 1.0 112.468 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . 0.403 ' H ' ' HB ' ' B' ' 966' ' ' VAL . 0.9 OUTLIER -86.51 130.39 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 O-C-N 120.433 -1.417 . . . . 1.0 110.437 -155.263 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -102.17 112.34 24.97 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.918 -1.739 . . . . 1.0 109.981 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 56.2 mt . . . . . 0 N--CA 1.437 -1.115 0 O-C-N 119.011 -2.306 . . . . 1.0 116.108 -174.492 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 68.1 m80 . . . . . 0 N--CA 1.433 -1.298 0 CA-C-O 121.768 0.794 . . . . 1.0 110.844 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.3 pt -143.02 160.84 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 130.488 3.515 . . . . 1.0 104.961 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -109.58 144.79 37.4 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 119.102 -2.249 . . . . 1.0 108.431 166.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -128.2 154.29 45.98 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.425 -2.047 . . . . 1.0 105.792 170.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.07 150.68 44.7 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.701 -1.874 . . . . 1.0 111.756 169.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -110.9 136.78 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 O-C-N 121.166 -0.959 . . . . 1.0 108.64 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.17 130.15 53.58 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 124.494 1.118 . . . . 1.0 111.945 -174.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.381 0 CA-C-O 122.915 1.286 . . . . 1.0 113.999 -177.514 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p . . . . . 0 N--CA 1.434 -1.239 0 N-CA-C 109.077 -0.712 . . . . 1.0 109.077 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.311 0.3 OUTLIER -129.36 135.86 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.105 0 O-C-N 119.692 -1.88 . . . . 1.0 111.164 166.15 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.13 153.98 23.94 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 124.794 2.235 . . . . 1.0 114.377 175.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.5 140.53 37.24 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 106.477 -1.675 . . . . 1.0 106.477 -170.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -99.54 118.08 35.33 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.191 1.796 . . . . 1.0 107.084 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.7 tt -143.84 154.72 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.423 0 C-N-CA 126.595 1.958 . . . . 1.0 109.556 -154.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -116.55 161.16 19.57 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 113.172 -1.831 . . . . 1.0 112.399 -173.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -61.41 -38.02 85.59 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 125.329 1.452 . . . . 1.0 114.707 -164.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -101.08 14.5 31.76 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 124.373 1.069 . . . . 1.0 113.515 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.2 m -86.45 121.48 72.3 Favored Pre-proline 0 CA--C 1.497 -1.065 0 CA-C-O 116.703 -1.618 . . . . 1.0 109.367 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.31 158.95 41.99 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 CA-C-N 125.653 3.055 . . . . 1.0 115.534 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.403 1.3 pp -63.63 -25.57 68.28 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 125.302 1.441 . . . . 1.0 114.404 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -52.72 -29.11 25.05 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.501 -1.374 . . . . 1.0 114.222 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -42.69 68.86 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.442 -1.411 . . . . 1.0 111.524 -176.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.67 -37.14 84.17 Favored 'General case' 0 N--CA 1.434 -1.239 0 O-C-N 120.467 -1.396 . . . . 1.0 113.283 171.12 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.8 ttm -61.94 -42.63 99.33 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 119.83 -1.794 . . . . 1.0 113.872 175.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -43.57 98.45 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.746 1.26 . . . . 1.0 112.326 175.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.13 89.94 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 125.506 1.522 . . . . 1.0 113.837 177.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -61.03 -42.38 98.36 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 125.626 1.57 . . . . 1.0 111.561 172.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.2 m -63.57 -43.17 97.8 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.915 -1.116 . . . . 1.0 113.528 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.56 -48.78 63.37 Favored 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 124.36 1.064 . . . . 1.0 113.394 177.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -73.6 -43.02 60.76 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 116.537 2.051 . . . . 1.0 116.537 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -112.9 10.15 18.96 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.957 -1.089 . . . . 1.0 111.883 -165.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.0 43.17 10.05 Favored Glycine 0 CA--C 1.494 -1.246 0 N-CA-C 117.869 1.908 . . . . 1.0 117.869 160.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.5 mt -123.3 161.93 23.67 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 121.1 -1.235 . . . . 1.0 110.556 -168.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.8 m -102.23 133.21 47.48 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 120.137 -1.602 . . . . 1.0 111.084 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.5 tpt -58.68 -39.33 80.38 Favored 'General case' 0 N--CA 1.437 -1.112 0 N-CA-C 116.662 2.097 . . . . 1.0 116.662 -167.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -92.57 1.47 57.24 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.565 -1.334 . . . . 1.0 112.588 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -100.14 -21.82 15.41 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 124.486 1.114 . . . . 1.0 112.601 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.8 pt -112.95 149.66 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 124.252 1.021 . . . . 1.0 108.947 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.23 154.99 49.07 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.837 -1.164 . . . . 1.0 109.102 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -115.08 147.28 40.38 Favored 'General case' 0 N--CA 1.434 -1.243 0 O-C-N 120.934 -1.104 . . . . 1.0 110.613 -173.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 58.9 mtm180 -130.94 161.06 32.73 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 121.212 -0.93 . . . . 1.0 110.95 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -131.91 114.52 14.75 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.083 0.468 . . . . 1.0 109.99 164.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 t0 53.79 42.36 31.79 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 127.311 2.244 . . . . 1.0 114.066 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.95 0.78 83.27 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 124.978 1.275 . . . . 1.0 115.761 -176.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -99.9 137.6 20.18 Favored Pre-proline 0 N--CA 1.434 -1.242 0 O-C-N 120.337 -1.684 . . . . 1.0 109.53 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.97 137.66 24.57 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 CA-C-N 122.873 2.062 . . . . 1.0 112.127 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 19.4 pt -118.42 140.52 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.14 0 N-CA-C 106.011 -1.848 . . . . 1.0 106.011 177.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -106.64 161.52 14.57 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.163 -1.585 . . . . 1.0 109.711 -166.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -57.79 -34.97 70.19 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.403 -2.06 . . . . 1.0 115.532 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -78.55 -12.64 60.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.282 1.033 . . . . 1.0 113.145 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -74.04 170.52 15.27 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 119.475 -2.015 . . . . 1.0 111.66 177.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 63.9 p -148.02 162.31 31.51 Favored Pre-proline 0 CA--C 1.499 -0.992 0 O-C-N 119.065 -2.272 . . . . 1.0 112.746 -153.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_exo -55.04 -36.52 92.95 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 124.389 3.393 . . . . 1.0 115.857 163.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.55 -45.6 89.77 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 119.556 1.071 . . . . 1.0 113.639 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.61 -44.97 76.78 Favored 'General case' 0 N--CA 1.432 -1.345 0 C-N-CA 124.706 1.202 . . . . 1.0 112.624 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -90.6 -8.5 49.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 120.527 -1.358 . . . . 1.0 113.15 -176.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 69.48 37.79 1.91 Allowed 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 128.573 2.749 . . . . 1.0 114.675 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 52.5 mtt -58.19 152.76 16.4 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 128.326 2.65 . . . . 1.0 115.593 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.3 178.32 5.42 Favored 'General case' 0 N--CA 1.433 -1.307 0 O-C-N 121.139 -0.976 . . . . 1.0 109.666 -167.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.346 14.3 p-10 -54.38 -26.56 30.92 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 117.246 2.313 . . . . 1.0 117.246 -174.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -136.66 62.03 1.62 Allowed 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.52 1.528 . . . . 1.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.63 166.45 20.71 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 119.203 -2.186 . . . . 1.0 115.21 -177.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.7 m -133.56 121.56 22.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 O-C-N 121.04 -1.037 . . . . 1.0 110.7 -174.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.2 mm -118.67 140.71 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.103 0 C-N-CA 126.954 2.102 . . . . 1.0 109.327 -175.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -110.97 141.73 44.04 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.993 -1.692 . . . . 1.0 109.256 -167.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.1 t -108.49 128.97 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.181 0 CA-C-O 122.41 1.1 . . . . 1.0 109.842 -176.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -116.45 139.67 50.2 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 122.742 1.258 . . . . 1.0 111.159 173.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -96.84 120.32 36.96 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 121.254 -0.904 . . . . 1.0 111.81 -167.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 . . . . . 0 N--CA 1.435 -1.195 0 O-C-N 120.831 -1.168 . . . . 1.0 110.596 174.59 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.27 0.2 OUTLIER . . . . . 0 N--CA 1.437 -1.114 0 N-CA-C 114.601 1.334 . . . . 1.0 114.601 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -108.68 116.57 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 N-CA-C 107.418 -1.327 . . . . 1.0 107.418 -172.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -102.21 110.66 22.68 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.918 -1.739 . . . . 1.0 106.671 167.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.5 pp . . . . . 0 CA--C 1.498 -1.057 0 O-C-N 120.048 -1.657 . . . . 1.0 113.621 -170.823 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.435 -1.195 0 N-CA-C 114.526 1.306 . . . . 1.0 114.526 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.2 pt -142.95 160.82 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.299 1 C-N-CA 131.893 4.077 . . . . 1.0 106.096 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -113.89 144.93 42.22 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 117.722 -3.111 . . . . 1.0 110.112 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.95 148.51 51.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 119.036 -2.29 . . . . 1.0 107.689 171.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.6 ptpt -115.03 150.63 35.58 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 119.478 -2.014 . . . . 1.0 111.63 169.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.8 p -119.59 131.57 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 O-C-N 121.062 -1.023 . . . . 1.0 108.822 175.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.62 130.25 51.26 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 122.791 1.281 . . . . 1.0 112.654 -175.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.429 0 CA-C-O 123.328 1.516 . . . . 1.0 115.572 -177.614 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.437 -1.125 0 CA-C-O 121.71 0.767 . . . . 1.0 112.031 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -129.21 138.74 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 O-C-N 119.722 -1.861 . . . . 1.0 110.842 167.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.68 146.4 39.87 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-O 124.688 2.185 . . . . 1.0 114.138 176.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.54 140.62 49.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.827 -1.796 . . . . 1.0 107.591 -170.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -100.34 116.54 32.55 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 125.231 1.412 . . . . 1.0 109.491 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 11.3 tt -141.73 154.85 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.39 0 C-N-CA 128.167 2.587 . . . . 1.0 110.11 -152.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.55 164.28 14.54 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 112.974 -1.921 . . . . 1.0 112.448 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -67.28 -38.07 84.47 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 115.081 1.512 . . . . 1.0 115.081 -165.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -98.11 31.09 2.84 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 124.861 1.264 . . . . 1.0 112.08 174.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.4 m -114.65 111.68 45.99 Favored Pre-proline 0 N--CA 1.436 -1.153 0 O-C-N 120.585 -1.322 . . . . 1.0 107.596 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -62.04 160.17 31.18 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 123.98 3.12 . . . . 1.0 116.432 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.378 2.0 pp -63.89 -25.65 68.25 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 122.941 1.353 . . . . 1.0 114.15 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 t -52.51 -29.21 23.95 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 125.289 1.435 . . . . 1.0 113.896 169.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -66.75 -44.04 82.52 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.124 -1.61 . . . . 1.0 112.876 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.08 -32.2 70.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.493 -1.379 . . . . 1.0 113.101 174.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.0 ttm -60.59 -44.43 96.26 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 120.277 -1.514 . . . . 1.0 114.175 173.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -66.15 -38.25 87.67 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.566 -1.333 . . . . 1.0 113.339 172.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.93 85.31 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 120.179 -1.575 . . . . 1.0 114.048 175.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -62.55 -41.6 99.0 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 125.846 1.658 . . . . 1.0 112.257 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.5 -44.02 97.4 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 125.467 1.507 . . . . 1.0 113.014 171.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -64.9 -50.01 68.21 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.32 -1.487 . . . . 1.0 114.101 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -77.04 -43.34 34.92 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 115.345 1.609 . . . . 1.0 115.345 -177.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -113.44 -0.45 14.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.899 -1.125 . . . . 1.0 112.013 -165.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 2.69 89.15 Favored Glycine 0 CA--C 1.493 -1.283 0 N-CA-C 117.713 1.845 . . . . 1.0 117.713 164.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.45 153.21 37.74 Favored 'General case' 0 N--CA 1.433 -1.31 0 O-C-N 120.856 -1.379 . . . . 1.0 111.993 -170.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.2 m -99.32 127.73 45.37 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 120.724 -1.235 . . . . 1.0 109.442 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.6 ptp -66.53 -20.79 66.11 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.036 -1.665 . . . . 1.0 115.133 -174.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptt85 -75.75 -11.07 59.92 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 124.57 1.148 . . . . 1.0 114.019 170.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -109.38 -8.37 15.07 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.336 -1.477 . . . . 1.0 113.594 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.1 pt -128.49 150.19 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.16 0 O-C-N 120.128 -1.607 . . . . 1.0 109.99 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.24 150.0 46.29 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 107.959 -1.126 . . . . 1.0 107.959 170.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -108.38 144.58 35.76 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 121.206 -0.934 . . . . 1.0 109.676 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -134.13 159.1 41.9 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 122.48 1.133 . . . . 1.0 111.24 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -139.1 123.55 18.29 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 108.048 -1.094 . . . . 1.0 108.048 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 56.27 38.39 29.74 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 126.211 1.804 . . . . 1.0 113.351 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.28 2.73 84.42 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 116.287 1.275 . . . . 1.0 116.287 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -116.13 140.62 26.6 Favored Pre-proline 0 N--CA 1.435 -1.196 0 CA-C-N 120.094 1.947 . . . . 1.0 109.642 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -48.82 135.3 28.5 Favored 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 124.155 3.237 . . . . 1.0 117.245 169.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 pt -117.93 138.19 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.242 0 N-CA-C 106.329 -1.73 . . . . 1.0 106.329 169.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -104.12 167.14 9.95 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 121.096 -1.003 . . . . 1.0 109.887 -162.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -78.14 -16.54 57.85 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.032 -2.293 . . . . 1.0 111.259 -176.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.21 -13.83 59.45 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 130.959 3.703 . . . . 1.0 113.607 167.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -86.08 169.61 12.99 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 119.639 -1.913 . . . . 1.0 111.361 171.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.2 p -151.51 161.15 30.47 Favored Pre-proline 0 CA--C 1.496 -1.1 0 O-C-N 120.201 -1.562 . . . . 1.0 110.612 -158.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -58.42 -31.56 94.34 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 C-N-CA 123.846 3.031 . . . . 1.0 115.32 167.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.44 -46.07 74.2 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 119.544 1.065 . . . . 1.0 113.033 172.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -69.31 -37.73 77.91 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 124.499 1.12 . . . . 1.0 113.755 -176.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -95.18 -0.63 53.03 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 120.807 -1.183 . . . . 1.0 111.86 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 56.15 42.61 28.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 127.541 2.336 . . . . 1.0 115.86 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.8 mtt -59.84 149.42 31.41 Favored 'General case' 0 N--CA 1.434 -1.275 0 C-N-CA 127.126 2.17 . . . . 1.0 113.748 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -109.67 -172.38 2.03 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 121.358 -0.839 . . . . 1.0 109.113 -165.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.363 14.0 p-10 -60.21 -26.47 66.42 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.045 -1.659 . . . . 1.0 115.119 176.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -143.61 87.51 1.94 Allowed 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 124.416 1.087 . . . . 1.0 110.426 170.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.44 169.29 11.19 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 114.794 1.405 . . . . 1.0 114.794 178.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.3 m -136.45 123.13 21.06 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 124.874 1.269 . . . . 1.0 109.822 -175.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.8 mm -121.47 140.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 126.297 1.839 . . . . 1.0 108.883 -175.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -110.91 141.76 43.9 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.049 -1.657 . . . . 1.0 108.891 -171.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -108.59 139.63 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.142 0 O-C-N 120.522 -1.361 . . . . 1.0 109.542 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -124.45 137.46 54.44 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 122.206 1.003 . . . . 1.0 108.959 167.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -81.88 133.3 35.31 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.355 1.062 . . . . 1.0 112.228 -174.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 . . . . . 0 N--CA 1.435 -1.206 0 C-N-CA 124.972 1.309 . . . . 1.0 111.029 -174.985 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.272 0.2 OUTLIER . . . . . 0 CA--C 1.495 -1.137 0 N-CA-C 115.145 1.535 . . . . 1.0 115.145 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.1 mt -110.53 123.88 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 C-N-CA 124.218 1.007 . . . . 1.0 108.97 -170.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -102.14 105.63 16.36 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.52 -1.362 . . . . 1.0 108.294 165.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.9 pp . . . . . 0 N--CA 1.436 -1.171 0 O-C-N 120.624 -1.297 . . . . 1.0 113.022 -178.268 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.435 -1.197 0 N-CA-C 116.295 1.961 . . . . 1.0 116.295 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.4 pt -138.06 160.78 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 129.132 2.973 . . . . 1.0 105.316 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -111.75 144.9 40.27 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.252 -2.155 . . . . 1.0 108.832 177.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -129.43 156.13 44.59 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 119.474 -2.016 . . . . 1.0 106.331 170.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.58 150.58 45.77 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 119.433 -2.042 . . . . 1.0 111.453 166.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 p -118.27 137.95 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 N-CA-C 108.377 -0.972 . . . . 1.0 108.377 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.88 130.2 49.71 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 121.356 -0.84 . . . . 1.0 112.498 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.364 0 CA-C-O 122.333 0.963 . . . . 1.0 114.587 -178.621 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 N--CA 1.434 -1.243 0 CA-C-O 121.89 0.852 . . . . 1.0 108.853 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.292 0.3 OUTLIER -129.42 138.75 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 O-C-N 120.4 -1.437 . . . . 1.0 111.717 173.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.06 149.91 39.52 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 124.058 1.885 . . . . 1.0 115.022 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.49 140.58 31.91 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.534 -1.354 . . . . 1.0 108.974 -162.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -104.22 115.84 31.12 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 125.283 1.433 . . . . 1.0 113.172 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 13.5 tt -141.32 154.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-O 124.614 2.15 . . . . 1.0 111.576 -154.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -93.7 153.98 18.05 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 112.272 -2.24 . . . . 1.0 113.504 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 68.9 mtt-85 -69.8 -38.17 76.55 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 115.783 1.772 . . . . 1.0 115.783 -172.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -101.43 33.99 2.74 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.29 -1.506 . . . . 1.0 112.367 -174.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.32 155.11 80.54 Favored Pre-proline 0 CA--C 1.496 -1.114 0 O-C-N 120.601 -1.312 . . . . 1.0 108.119 -173.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -78.12 149.85 25.69 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 CA-C-N 124.241 2.55 . . . . 1.0 114.351 -167.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.336 2.1 pp -61.02 -25.53 66.98 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 125.876 1.67 . . . . 1.0 114.512 172.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 92.3 p -52.7 -29.04 24.54 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 119.366 -2.083 . . . . 1.0 113.823 171.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -65.33 -40.88 94.27 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.632 -1.293 . . . . 1.0 112.74 -174.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.9 -37.73 84.93 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.609 -1.307 . . . . 1.0 113.686 167.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 54.7 ttm -60.81 -42.12 97.04 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.097 -1.627 . . . . 1.0 113.908 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.83 -43.33 99.09 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.909 -1.119 . . . . 1.0 112.395 174.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.41 83.82 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.528 -1.358 . . . . 1.0 114.477 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -60.2 -42.76 95.76 Favored 'General case' 0 N--CA 1.436 -1.161 0 C-N-CA 125.959 1.704 . . . . 1.0 112.033 174.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.4 m -62.15 -41.65 98.49 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 124.793 1.237 . . . . 1.0 113.791 176.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.99 -47.29 75.04 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 114.289 1.218 . . . . 1.0 114.289 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -75.86 -42.99 47.81 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 116.185 1.92 . . . . 1.0 116.185 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -114.07 11.89 17.78 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.868 -1.145 . . . . 1.0 112.551 -161.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.34 43.71 19.43 Favored Glycine 0 CA--C 1.494 -1.244 0 N-CA-C 117.078 1.591 . . . . 1.0 117.078 164.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.4 mt -124.63 156.5 37.4 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 124.334 1.054 . . . . 1.0 111.154 -169.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.5 m -102.2 131.35 48.79 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.543 -1.348 . . . . 1.0 111.01 170.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -65.02 -24.5 67.52 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 116.317 1.969 . . . . 1.0 116.317 -170.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -89.69 -3.46 58.21 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.258 -1.526 . . . . 1.0 112.848 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -100.87 -15.91 17.42 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.715 -1.241 . . . . 1.0 111.849 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.2 pt -114.42 147.09 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 C-N-CA 125.312 1.445 . . . . 1.0 108.322 174.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -137.75 152.22 48.98 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.154 -1.424 . . . . 1.0 107.154 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.8 m-30 -109.4 148.59 30.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-O 123.079 1.418 . . . . 1.0 109.956 -173.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -139.62 140.97 37.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 108.023 -1.103 . . . . 1.0 108.023 -168.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -127.01 115.96 20.02 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.12 -1.437 . . . . 1.0 107.12 171.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t70 59.16 40.11 22.14 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 125.48 1.512 . . . . 1.0 114.117 171.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.71 5.17 90.15 Favored Glycine 0 N--CA 1.438 -1.216 0 N-CA-C 116.173 1.229 . . . . 1.0 116.173 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -117.17 136.67 23.45 Favored Pre-proline 0 N--CA 1.433 -1.278 0 O-C-N 120.291 -1.711 . . . . 1.0 109.97 -173.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -58.51 137.46 80.44 Favored 'Trans proline' 0 N--CA 1.44 -1.631 0 C-N-CA 123.539 2.826 . . . . 1.0 114.558 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.0 pt -117.13 135.68 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 N-CA-C 106.206 -1.776 . . . . 1.0 106.206 171.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -100.59 163.9 12.14 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.363 -1.461 . . . . 1.0 110.232 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.87 -17.55 61.52 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 119.053 -2.279 . . . . 1.0 113.598 -178.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 98.9 m -78.6 -19.78 51.96 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 125.665 1.586 . . . . 1.0 112.53 167.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -76.61 170.7 15.93 Favored 'General case' 0 N--CA 1.432 -1.355 0 O-C-N 119.702 -1.874 . . . . 1.0 112.153 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 77.2 p -149.25 159.07 37.7 Favored Pre-proline 0 CA--C 1.495 -1.154 0 O-C-N 119.861 -1.775 . . . . 1.0 109.556 -158.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -58.04 -35.05 99.04 Favored 'Trans proline' 0 N--CA 1.439 -1.69 0 C-N-CA 123.334 2.689 . . . . 1.0 114.94 168.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.97 83.26 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 113.916 1.08 . . . . 1.0 113.916 176.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -68.94 -42.52 76.62 Favored 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 124.845 1.258 . . . . 1.0 113.56 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -86.01 -8.47 57.93 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 121.926 0.87 . . . . 1.0 111.073 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 66.7 44.35 2.21 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 127.196 2.199 . . . . 1.0 114.259 175.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 60.3 mtt -62.05 154.24 27.38 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 128.598 2.759 . . . . 1.0 113.398 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -113.3 178.23 4.35 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 107.981 -1.118 . . . . 1.0 107.981 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.459 10.2 p-10 -54.23 -26.5 28.9 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 117.164 2.283 . . . . 1.0 117.164 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -138.28 58.5 1.67 Allowed 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 125.887 1.675 . . . . 1.0 112.069 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.89 161.61 29.59 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 116.233 1.938 . . . . 1.0 116.233 -171.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 61.2 m -129.04 116.42 19.28 Favored 'General case' 0 CA--C 1.497 -1.065 0 C-N-CA 125.011 1.325 . . . . 1.0 111.971 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.7 mm -120.74 140.91 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 C-N-CA 127.974 2.51 . . . . 1.0 109.842 -170.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -110.93 143.86 40.91 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 119.528 -1.983 . . . . 1.0 108.918 -167.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.4 t -108.66 126.25 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.214 0 O-C-N 120.955 -1.091 . . . . 1.0 108.762 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -113.6 134.84 54.48 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 123.403 1.573 . . . . 1.0 107.543 172.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -106.33 124.65 49.92 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.923 -1.111 . . . . 1.0 110.751 -161.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 . . . . . 0 N--CA 1.436 -1.157 0 O-C-N 120.777 -1.202 . . . . 1.0 112.597 -174.646 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.495 -1.17 0 N-CA-C 115.285 1.587 . . . . 1.0 115.285 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.4 mt -113.08 119.01 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 C-N-CA 125.11 1.364 . . . . 1.0 110.18 -173.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -102.02 115.65 31.0 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.06 -1.65 . . . . 1.0 106.808 165.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.072 0 CA-C-N 121.667 2.031 . . . . 1.0 114.581 -174.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 . . . . . 0 N--CA 1.436 -1.129 0 N-CA-C 117.141 2.274 . . . . 1.0 117.141 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.3 pt -129.57 160.66 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 129.346 3.058 . . . . 1.0 106.153 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.75 144.79 44.98 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.925 -2.985 . . . . 1.0 111.027 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -131.52 151.38 51.63 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.286 -2.134 . . . . 1.0 107.992 170.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt -121.38 150.61 41.23 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 119.908 -1.745 . . . . 1.0 110.697 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.52 131.9 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 N-CA-C 108.314 -0.995 . . . . 1.0 108.314 174.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.75 132.43 54.61 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 124.759 1.224 . . . . 1.0 111.027 -174.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.49 0 N-CA-C 109.236 -1.546 . . . . 1.0 109.236 176.793 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.436 -1.143 0 N-CA-C 109.501 -0.555 . . . . 1.0 109.501 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.292 0.3 OUTLIER -129.31 138.72 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 O-C-N 119.846 -1.784 . . . . 1.0 111.208 166.4 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.31 147.21 41.77 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-O 125.393 2.521 . . . . 1.0 114.425 176.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -127.23 140.58 52.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.331 -1.729 . . . . 1.0 106.331 -173.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -101.23 115.85 31.44 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.835 2.454 . . . . 1.0 107.164 176.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 9.6 tt -137.7 154.72 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 CA-C-O 125.57 2.605 . . . . 1.0 109.362 -155.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 mtpp -108.74 164.16 12.62 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 110.967 -2.833 . . . . 1.0 111.775 -165.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -59.41 -38.01 79.53 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.989 1.848 . . . . 1.0 115.989 -160.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 -116.65 33.73 5.43 Favored 'General case' 0 N--CA 1.432 -1.35 0 O-C-N 120.958 -1.089 . . . . 1.0 111.759 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.8 m -90.77 124.85 61.1 Favored Pre-proline 0 N--CA 1.438 -1.072 0 O-C-N 120.654 -1.279 . . . . 1.0 109.938 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.73 159.82 52.02 Favored 'Trans proline' 0 N--CA 1.441 -1.615 0 C-N-CA 122.988 2.459 . . . . 1.0 114.615 175.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.359 1.0 OUTLIER -64.99 -25.79 68.01 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 114.805 1.409 . . . . 1.0 114.805 179.841 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.8 p -52.77 -29.24 26.18 Favored 'General case' 0 N--CA 1.437 -1.108 0 O-C-N 120.097 -1.627 . . . . 1.0 115.379 168.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.04 -42.9 68.9 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.042 -1.661 . . . . 1.0 112.572 -175.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.77 -35.68 81.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.67 -1.269 . . . . 1.0 113.527 172.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.9 ttm -61.75 -43.1 99.51 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 120.233 -1.542 . . . . 1.0 113.771 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -42.75 99.3 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 120.926 -1.108 . . . . 1.0 112.969 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.2 86.79 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.515 1.126 . . . . 1.0 113.759 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.38 -42.59 98.96 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.574 1.55 . . . . 1.0 112.212 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.2 m -61.88 -43.69 98.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.528 1.131 . . . . 1.0 113.525 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.58 -48.66 68.89 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.667 1.358 . . . . 1.0 114.667 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.1 -43.18 62.1 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 119.886 -1.759 . . . . 1.0 115.558 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -113.58 8.95 17.85 Favored 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 121.129 -0.982 . . . . 1.0 112.389 -165.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.63 9.84 85.11 Favored Glycine 0 CA--C 1.494 -1.267 0 N-CA-C 116.815 1.486 . . . . 1.0 116.815 162.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.7 mt -81.61 166.34 20.29 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 125.323 1.449 . . . . 1.0 113.238 -174.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -102.21 139.64 37.56 Favored 'General case' 0 CA--C 1.494 -1.21 0 O-C-N 120.563 -1.336 . . . . 1.0 112.245 170.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -29.25 70.63 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.1 1.36 . . . . 1.0 113.484 -178.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.6 ptt180 -95.0 -6.94 41.15 Favored 'General case' 0 N--CA 1.433 -1.291 0 C-N-CA 124.185 0.994 . . . . 1.0 112.771 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -94.6 -22.53 18.12 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.185 -1.572 . . . . 1.0 111.065 174.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 18.9 pt -110.2 145.03 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 CA-C-O 121.475 0.655 . . . . 1.0 112.368 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -138.17 154.95 49.13 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.403 -1.436 . . . . 1.0 109.176 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -115.41 148.67 39.08 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.502 -1.373 . . . . 1.0 112.803 -169.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.75 151.82 48.52 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 126.686 1.994 . . . . 1.0 109.133 175.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -130.84 116.19 17.6 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 108.797 -0.816 . . . . 1.0 108.797 167.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 37.5 t0 55.08 44.07 28.62 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 125.385 1.474 . . . . 1.0 113.31 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.79 2.43 81.36 Favored Glycine 0 N--CA 1.437 -1.288 0 O-C-N 120.314 -1.491 . . . . 1.0 115.924 -177.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -108.93 128.78 24.85 Favored Pre-proline 0 N--CA 1.435 -1.194 0 O-C-N 120.498 -1.59 . . . . 1.0 109.779 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -53.06 135.3 58.73 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 123.469 2.779 . . . . 1.0 116.435 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 pt -119.98 141.4 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.249 -1.389 . . . . 1.0 107.249 174.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.76 160.46 16.71 Favored 'General case' 0 N--CA 1.435 -1.224 0 O-C-N 120.727 -1.233 . . . . 1.0 109.182 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.77 -30.07 70.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 119.82 -1.8 . . . . 1.0 114.14 -173.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.1 m -96.58 6.25 49.1 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.36 1.464 . . . . 1.0 112.489 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -71.2 178.84 3.11 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 118.411 -2.68 . . . . 1.0 113.205 173.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.0 p -120.79 151.96 55.32 Favored Pre-proline 0 CA--C 1.498 -1.019 0 O-C-N 120.151 -1.593 . . . . 1.0 113.557 -161.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -56.4 -30.83 83.14 Favored 'Trans proline' 0 N--CA 1.442 -1.5 0 C-N-CA 123.806 3.004 . . . . 1.0 116.637 170.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.99 87.97 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 114.141 1.163 . . . . 1.0 114.141 173.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.21 -36.76 82.37 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 126.414 1.886 . . . . 1.0 112.793 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.3 tp -81.6 -8.49 59.72 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-O 122.795 1.283 . . . . 1.0 111.399 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 56.58 48.26 16.93 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 127.048 2.139 . . . . 1.0 113.376 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 93.7 mtp -62.19 143.48 56.72 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 115.73 1.752 . . . . 1.0 115.73 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -148.57 179.65 7.65 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 106.103 -1.814 . . . . 1.0 106.103 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.284 2.2 p30 -54.86 -26.57 36.38 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 116.655 2.094 . . . . 1.0 116.655 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -135.19 105.19 6.2 Favored 'General case' 0 N--CA 1.436 -1.166 0 C-N-CA 125.446 1.498 . . . . 1.0 108.219 162.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -100.18 158.73 15.65 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.714 -1.241 . . . . 1.0 112.135 164.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.4 m -136.35 115.29 12.25 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 124.251 1.02 . . . . 1.0 110.57 -176.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 10.0 mm -120.32 140.81 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.962 2.505 . . . . 1.0 109.219 -166.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -110.79 142.27 43.0 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 119.072 -2.268 . . . . 1.0 108.425 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.7 p -120.38 136.71 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.172 0 C-N-CA 125.114 1.366 . . . . 1.0 109.305 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -133.74 145.13 49.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 124.438 1.095 . . . . 1.0 108.067 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -105.83 132.59 51.76 Favored 'General case' 0 N--CA 1.433 -1.278 0 O-C-N 120.551 -1.343 . . . . 1.0 113.28 -169.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 . . . . . 0 N--CA 1.435 -1.193 0 C-N-CA 124.974 1.31 . . . . 1.0 112.755 -173.752 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.333 0.2 OUTLIER . . . . . 0 N--CA 1.434 -1.25 0 N-CA-C 116.143 1.905 . . . . 1.0 116.143 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -112.37 113.47 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 O-C-N 121.51 -0.743 . . . . 1.0 109.495 -168.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.04 122.45 44.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.662 -1.899 . . . . 1.0 109.667 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 66.8 mt . . . . . 0 N--CA 1.437 -1.096 0 N-CA-C 115.748 1.758 . . . . 1.0 115.748 -172.099 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 . . . . . 0 N--CA 1.432 -1.357 0 CA-C-O 121.946 0.879 . . . . 1.0 108.957 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.6 pt -138.19 160.72 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 C-N-CA 129.975 3.31 . . . . 1.0 106.198 -171.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -117.89 144.89 45.04 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 119.353 -2.092 . . . . 1.0 110.712 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -134.03 160.83 36.56 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 118.761 -2.462 . . . . 1.0 108.334 173.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -131.7 150.66 52.08 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 119.985 -1.697 . . . . 1.0 112.914 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.0 t -119.12 119.28 60.35 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 N-CA-C 107.407 -1.331 . . . . 1.0 107.407 176.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -113.55 130.14 56.42 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.79 0.805 . . . . 1.0 111.918 -170.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.502 0 CA-C-O 122.948 1.305 . . . . 1.0 115.32 -175.141 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.9 p . . . . . 0 N--CA 1.434 -1.237 0 N-CA-C 110.176 -0.305 . . . . 1.0 110.176 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.23 138.74 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.119 0 O-C-N 120.868 -1.145 . . . . 1.0 108.983 174.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.479 ' H ' HG22 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -112.68 160.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 126.729 3.157 . . . . 1.0 114.42 179.934 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -145.1 140.64 28.18 Favored 'General case' 0 N--CA 1.428 -1.548 0 O-C-N 118.838 -2.414 . . . . 1.0 107.883 -165.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.277 30.0 ttpt -104.98 115.89 31.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.315 2.246 . . . . 1.0 113.994 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.437 ' HB ' HD13 ' B' ' 969' ' ' LEU . 6.3 tt -142.67 154.67 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.356 0 CA-C-O 124.007 1.86 . . . . 1.0 110.612 -154.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.266 3.7 mppt? -107.19 165.79 11.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 113.843 -1.526 . . . . 1.0 113.668 -175.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -63.28 -38.05 89.66 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 -160.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -99.14 -4.07 33.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.607 -1.308 . . . . 1.0 112.498 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 m -60.45 134.41 91.34 Favored Pre-proline 0 N--CA 1.437 -1.123 0 C-N-CA 126.294 1.838 . . . . 1.0 113.576 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.73 160.73 37.47 Favored 'Trans proline' 0 N--CA 1.441 -1.6 0 C-N-CA 122.867 2.378 . . . . 1.0 113.712 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.375 1.0 OUTLIER -65.58 -25.56 67.46 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 126.101 1.76 . . . . 1.0 114.066 178.613 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.2 p -52.8 -29.02 25.21 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 115.822 1.786 . . . . 1.0 115.822 173.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -65.39 -43.79 89.58 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 119.962 1.256 . . . . 1.0 114.079 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.69 -31.06 68.88 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.052 -1.655 . . . . 1.0 112.693 177.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 tpp -60.43 -43.57 96.66 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 120.703 -1.248 . . . . 1.0 113.7 171.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -61.57 -43.35 99.03 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.696 -1.252 . . . . 1.0 113.381 171.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.38 -34.04 73.94 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.739 -1.85 . . . . 1.0 114.147 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.4 -36.88 79.15 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 127.217 2.207 . . . . 1.0 111.56 170.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 53' ' ' LEU . 77.7 m -69.9 -30.76 68.26 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 127.454 2.302 . . . . 1.0 113.671 170.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -67.07 -52.65 39.45 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 119.12 -2.237 . . . . 1.0 113.386 165.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -78.92 -43.44 24.75 Favored 'General case' 0 N--CA 1.437 -1.117 1 N-CA-C 125.339 5.311 . . . . 1.0 125.339 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -160.98 -18.03 0.05 Allowed 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 119.955 3.317 . . . . 1.0 119.955 -157.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.27 -37.56 4.29 Favored Glycine 0 CA--C 1.492 -1.375 0 O-C-N 118.55 -2.594 . . . . 1.0 110.83 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 48' ' ' CYS 0.884 0.1 OUTLIER 57.16 -28.49 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.397 2 N-CA-C 128.003 6.297 . . . . 1.0 128.003 161.769 . . . . . . . . 5 4 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.8 m -102.4 123.65 46.55 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 105.94 -1.874 . . . . 1.0 105.94 154.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -63.76 -18.52 64.15 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.689 -1.257 . . . . 1.0 112.564 169.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -90.86 -3.52 57.3 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 113.307 0.855 . . . . 1.0 113.307 174.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -82.07 -38.54 24.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 120.009 -1.682 . . . . 1.0 112.527 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.6 pp -128.03 141.95 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.125 0 O-C-N 121.295 -0.878 . . . . 1.0 112.959 -165.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 155.06 48.98 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.549 1.539 . . . . 1.0 108.738 174.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -106.13 144.96 32.1 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.677 -1.264 . . . . 1.0 112.578 -168.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -126.39 145.18 50.56 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 126.284 1.834 . . . . 1.0 112.771 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -116.38 111.74 20.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.657 1.183 . . . . 1.0 108.549 168.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 t70 48.06 50.39 16.06 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 126.72 2.008 . . . . 1.0 114.574 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.73 0.89 89.9 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 117.544 1.778 . . . . 1.0 117.544 -178.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -118.3 133.46 23.49 Favored Pre-proline 0 N--CA 1.435 -1.206 0 CA-C-N 120.549 2.175 . . . . 1.0 110.528 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_exo -48.0 135.22 23.87 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 124.424 3.416 . . . . 1.0 117.55 168.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.6 pt -116.58 154.97 18.13 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 C-N-CA 124.826 1.251 . . . . 1.0 107.849 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -103.33 160.49 14.64 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.927 -1.108 . . . . 1.0 110.096 -175.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -63.18 -28.2 69.89 Favored 'General case' 0 CA--C 1.496 -1.106 0 O-C-N 119.554 -1.966 . . . . 1.0 114.04 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.3 m -92.29 -0.26 57.41 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 120.98 -1.075 . . . . 1.0 112.022 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -67.84 174.59 3.55 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.489 -2.007 . . . . 1.0 113.54 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.6 p -111.01 150.52 42.03 Favored Pre-proline 0 N--CA 1.438 -1.069 0 O-C-N 120.275 -1.515 . . . . 1.0 112.32 -156.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -58.01 -32.98 96.66 Favored 'Trans proline' 0 N--CA 1.44 -1.62 0 C-N-CA 122.959 2.439 . . . . 1.0 115.585 170.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.79 -45.37 82.65 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -66.66 -34.36 77.69 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.755 1.622 . . . . 1.0 113.595 -177.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 42.3 tp -95.33 -5.15 44.12 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.951 1.701 . . . . 1.0 112.023 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 59.47 45.33 13.71 Favored 'General case' 0 N--CA 1.436 -1.131 0 C-N-CA 127.468 2.307 . . . . 1.0 114.817 175.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.0 mtp -65.76 135.96 55.6 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 116.503 2.038 . . . . 1.0 116.503 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -150.48 -173.77 4.56 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.66 1.584 . . . . 1.0 108.516 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -55.77 -26.72 47.25 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 118.157 2.651 . . . . 1.0 118.157 -172.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -141.49 83.15 1.85 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.747 1.219 . . . . 1.0 108.311 167.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -85.59 159.6 19.83 Favored 'General case' 0 CA--C 1.498 -1.058 0 O-C-N 120.667 -1.271 . . . . 1.0 112.538 175.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -127.59 128.2 45.16 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 124.481 1.112 . . . . 1.0 109.843 174.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 77.1 mt -118.31 140.78 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 129.256 3.022 . . . . 1.0 106.605 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -110.75 145.51 37.96 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 119.526 -1.984 . . . . 1.0 105.893 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -108.56 139.73 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.302 0 O-C-N 120.721 -1.237 . . . . 1.0 108.215 -171.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -119.3 135.26 54.79 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-O 123.054 1.407 . . . . 1.0 108.673 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 62.4 tp60 -81.99 120.58 25.43 Favored 'General case' 0 N--CA 1.432 -1.336 0 C-N-CA 125.344 1.458 . . . . 1.0 110.148 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 . . . . . 0 N--CA 1.433 -1.311 0 O-C-N 121.295 -0.878 . . . . 1.0 110.847 179.156 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . 0.479 HG22 ' H ' ' A' ' 31' ' ' GLN . 28.4 t . . . . . 0 N--CA 1.435 -1.202 0 CA-C-O 122.103 0.954 . . . . 1.0 111.943 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . 0.402 ' H ' ' HB ' ' B' ' 966' ' ' VAL . 0.4 OUTLIER -95.44 132.04 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 O-C-N 120.803 -1.185 . . . . 1.0 111.892 -157.092 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -102.0 107.95 19.24 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 125.509 1.524 . . . . 1.0 108.397 173.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . 0.437 HD13 ' HB ' ' A' ' 34' ' ' ILE . 0.5 OUTLIER . . . . . 0 CA--C 1.494 -1.2 0 O-C-N 119.741 -1.849 . . . . 1.0 114.85 -176.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.0 p-80 . . . . . 0 N--CA 1.43 -1.449 0 N-CA-C 117.475 2.398 . . . . 1.0 117.475 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -132.68 160.73 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 C-N-CA 130.98 3.712 . . . . 1.0 105.096 173.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -112.25 144.77 41.1 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.285 -2.135 . . . . 1.0 109.757 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -137.43 160.44 39.1 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.263 -2.148 . . . . 1.0 105.854 177.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -138.05 150.68 47.14 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 119.556 -1.965 . . . . 1.0 111.416 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.4 HG22 ' CE1' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -108.77 132.82 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.612 0 C-N-CA 125.781 1.632 . . . . 1.0 108.21 174.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.36 130.15 56.33 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 123.976 0.91 . . . . 1.0 109.419 173.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.391 0 CA-C-O 122.566 1.092 . . . . 1.0 114.992 -176.521 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.4 p . . . . . 0 N--CA 1.436 -1.156 0 CA-C-O 121.188 0.518 . . . . 1.0 112.231 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.26 0.7 OUTLIER -129.24 138.78 53.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 O-C-N 120.056 -1.653 . . . . 1.0 111.616 166.897 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.477 ' O ' ' HB ' ' B' ' 966' ' ' VAL . 0.0 OUTLIER -107.1 161.6 14.61 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 126.629 3.109 . . . . 1.0 115.686 173.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.4 ' CE1' HG22 ' A' ' 22' ' ' VAL . 3.6 m-85 -145.11 157.65 44.04 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.255 -2.778 . . . . 1.0 107.139 -173.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.268 24.1 ttpt -120.52 115.85 24.25 Favored 'General case' 0 N--CA 1.434 -1.238 0 C-N-CA 124.813 1.245 . . . . 1.0 109.686 -176.468 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.408 ' CG1' ' H ' ' A' ' 35' ' ' LYS . 18.6 tt -148.56 154.74 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 CA-C-O 125.121 2.391 . . . . 1.0 112.028 -162.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.408 ' H ' ' CG1' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -90.49 163.29 14.69 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 111.476 -2.602 . . . . 1.0 111.741 -177.033 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 71.0 mtt85 -71.29 -37.97 71.82 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 116.441 2.015 . . . . 1.0 116.441 -164.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -98.73 -11.51 21.85 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.581 -1.325 . . . . 1.0 112.33 -175.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.4 m -59.66 137.1 89.82 Favored Pre-proline 0 N--CA 1.435 -1.192 0 C-N-CA 126.291 1.836 . . . . 1.0 112.73 170.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -71.36 155.25 60.51 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 123.642 2.336 . . . . 1.0 114.994 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.399 2.0 pp -62.01 -25.57 67.73 Favored 'General case' 0 N--CA 1.434 -1.273 0 C-N-CA 125.539 1.535 . . . . 1.0 114.67 174.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.0 p -52.64 -29.11 24.46 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.281 -2.137 . . . . 1.0 114.86 170.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.82 -41.73 87.01 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 119.97 -1.707 . . . . 1.0 112.605 -174.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -37.28 84.96 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.78 -1.2 . . . . 1.0 113.85 170.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.0 ttm -60.2 -42.55 95.35 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 120.243 -1.536 . . . . 1.0 113.771 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.96 -43.62 98.47 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.539 -1.351 . . . . 1.0 112.497 172.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.73 -35.12 79.37 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 114.753 1.39 . . . . 1.0 114.753 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.55 -43.81 89.43 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 127.355 2.262 . . . . 1.0 111.767 174.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.8 m -62.25 -42.36 99.26 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 124.907 1.283 . . . . 1.0 113.531 173.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.09 -46.99 72.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 115.054 1.501 . . . . 1.0 115.054 176.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.8 mtt180 -75.6 -43.2 49.34 Favored 'General case' 0 CA--C 1.495 -1.136 0 O-C-N 120.276 -1.515 . . . . 1.0 114.722 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -114.98 8.93 15.94 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.12 0.785 . . . . 1.0 113.12 -162.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.14 9.47 86.07 Favored Glycine 0 N--CA 1.437 -1.285 0 N-CA-C 117.355 1.702 . . . . 1.0 117.355 161.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -85.82 162.77 18.5 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 121.321 -1.105 . . . . 1.0 113.446 -174.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.9 m -102.32 129.41 48.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 124.307 1.043 . . . . 1.0 110.307 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -66.54 -22.52 66.16 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 116.47 2.026 . . . . 1.0 116.47 -171.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -90.47 -1.59 57.9 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.317 -1.489 . . . . 1.0 112.759 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -100.49 -10.37 21.16 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.775 -1.203 . . . . 1.0 111.644 177.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -122.92 146.58 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 O-C-N 120.581 -1.324 . . . . 1.0 110.03 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -138.24 154.97 49.06 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.698 -1.223 . . . . 1.0 107.698 171.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -113.97 148.61 36.6 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.655 1.217 . . . . 1.0 110.74 -173.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -137.41 156.89 47.66 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.642 -1.286 . . . . 1.0 108.429 173.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -131.85 113.87 14.0 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 120.987 -1.071 . . . . 1.0 108.522 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 27.0 t0 53.5 46.52 26.0 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 125.534 1.534 . . . . 1.0 113.473 -177.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.65 5.78 86.42 Favored Glycine 0 N--CA 1.436 -1.32 0 O-C-N 120.209 -1.557 . . . . 1.0 116.838 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -119.12 133.14 23.73 Favored Pre-proline 0 N--CA 1.436 -1.136 0 CA-C-N 119.589 1.695 . . . . 1.0 110.137 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -73.43 142.24 32.89 Favored 'Trans proline' 0 C--N 1.308 -1.583 0 CA-C-N 124.173 2.526 . . . . 1.0 113.147 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.0 pt -120.13 145.43 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 C-N-CA 124.931 1.292 . . . . 1.0 109.968 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -109.8 162.89 14.03 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.568 -1.332 . . . . 1.0 111.001 -165.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -70.87 -13.93 62.21 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.738 -1.851 . . . . 1.0 112.796 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -83.07 -14.88 52.89 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 126.874 2.07 . . . . 1.0 112.656 169.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.87 172.24 11.56 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.744 -1.848 . . . . 1.0 111.634 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 82.7 p -147.18 157.25 46.2 Favored Pre-proline 0 CA--C 1.496 -1.097 0 O-C-N 119.962 -1.711 . . . . 1.0 110.202 -162.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -59.85 -32.53 95.49 Favored 'Trans proline' 0 N--CA 1.439 -1.685 0 C-N-CA 123.259 2.639 . . . . 1.0 115.17 170.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.59 -46.05 84.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 113.477 0.918 . . . . 1.0 113.477 175.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -68.22 -39.08 82.46 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.026 1.73 . . . . 1.0 113.355 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 17.4 tp -85.03 -8.47 58.69 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-O 121.809 0.814 . . . . 1.0 113.128 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 64.41 42.47 5.13 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 128.421 2.688 . . . . 1.0 114.996 174.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.73 154.37 39.64 Favored 'General case' 0 N--CA 1.432 -1.328 0 C-N-CA 127.836 2.454 . . . . 1.0 114.29 176.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -126.76 -175.32 3.37 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.488 -1.301 . . . . 1.0 107.488 -168.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.315 8.6 p-10 -56.51 -26.48 54.72 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 117.014 2.227 . . . . 1.0 117.014 -172.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -137.64 92.46 2.69 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 118.503 0.592 . . . . 1.0 111.682 162.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.72 164.8 11.69 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.833 -1.792 . . . . 1.0 115.119 174.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -126.65 120.08 28.61 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 122.52 1.153 . . . . 1.0 112.52 -173.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mt -105.7 140.73 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 C-N-CA 128.772 2.829 . . . . 1.0 109.078 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -110.92 136.08 50.47 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.305 -1.497 . . . . 1.0 107.97 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 36.5 t -115.17 138.93 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 O-C-N 120.96 -1.088 . . . . 1.0 109.546 -171.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -128.03 140.13 52.14 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-O 122.101 0.953 . . . . 1.0 110.391 172.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -90.24 126.69 35.92 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.269 1.028 . . . . 1.0 111.471 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 . . . . . 0 N--CA 1.434 -1.262 0 N-CA-C 116.178 1.918 . . . . 1.0 116.178 -167.382 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . 0.477 ' HB ' ' O ' ' A' ' 31' ' ' GLN . 34.2 t . . . . . 0 N--CA 1.435 -1.206 0 CA-C-O 121.621 0.724 . . . . 1.0 109.959 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -90.83 130.61 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 O-C-N 120.881 -1.137 . . . . 1.0 111.37 -155.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -102.07 121.9 43.08 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.177 -1.577 . . . . 1.0 111.663 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.435 -1.197 0 O-C-N 120.734 -1.228 . . . . 1.0 112.704 177.027 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m80 . . . . . 0 N--CA 1.435 -1.189 0 N-CA-C 115.123 1.527 . . . . 1.0 115.123 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.409 ' HB ' ' HA ' ' A' ' 80' ' ' ASP . 19.9 pt -134.54 160.7 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 C-N-CA 129.489 3.115 . . . . 1.0 105.045 174.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -117.8 144.74 45.08 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 119.286 -2.134 . . . . 1.0 109.717 175.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.97 157.51 43.89 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 119.531 -1.98 . . . . 1.0 108.495 166.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -119.02 150.62 39.65 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-O 122.795 1.283 . . . . 1.0 113.274 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.32 133.08 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 107.567 -1.272 . . . . 1.0 107.567 173.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -142.82 140.57 31.36 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.796 1.284 . . . . 1.0 114.371 -163.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.32 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.739 174.316 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 N--CA 1.434 -1.228 0 N-CA-C 107.82 -1.178 . . . . 1.0 107.82 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.403 HG21 ' CD1' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -129.14 135.02 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 119.681 -1.887 . . . . 1.0 108.535 161.478 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.71 145.04 26.16 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 123.298 1.523 . . . . 1.0 112.785 159.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -138.92 140.61 38.39 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.946 -1.096 . . . . 1.0 108.747 -164.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.431 31.3 ttpt -113.48 115.29 27.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.896 1.808 . . . . 1.0 111.798 -169.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.8 tp -142.68 154.86 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.484 0 CA-C-N 110.935 -2.848 . . . . 1.0 111.799 -153.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.254 9.2 mtpt -86.68 154.7 20.79 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 112.098 -2.319 . . . . 1.0 112.676 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -71.06 -18.05 62.58 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 117.756 2.502 . . . . 1.0 117.756 -151.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -99.65 -49.93 4.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 119.799 -1.813 . . . . 1.0 111.719 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.6 m -34.0 132.24 0.39 Allowed Pre-proline 0 N--CA 1.439 -1.023 0 C-N-CA 131.286 3.834 . . . . 1.0 118.819 -176.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.404 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 10.1 Cg_exo -45.34 152.41 0.77 Allowed 'Trans proline' 0 N--CA 1.443 -1.456 2 N-CA-C 125.464 5.14 . . . . 1.0 125.464 -165.989 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -71.18 -25.77 62.68 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 157.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . 0.273 80.9 p -57.67 -29.07 64.32 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.73 -1.856 . . . . 1.0 114.089 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.404 ' HG2' ' HB2' ' A' ' 39' ' ' PRO . 10.4 mmmt -62.16 -42.56 99.38 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.765 1.226 . . . . 1.0 111.075 174.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -42.9 82.82 Favored 'General case' 0 CA--C 1.491 -1.315 0 C-N-CA 127.639 2.376 . . . . 1.0 112.459 176.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.7 ttt -56.84 -43.07 80.75 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -65.74 -41.81 91.71 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.897 -1.127 . . . . 1.0 113.274 172.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.8 -38.71 91.76 Favored 'General case' 0 N--CA 1.435 -1.188 0 C-N-CA 124.68 1.192 . . . . 1.0 113.922 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CD1' HG21 ' A' ' 30' ' ' VAL . 3.2 t80 -60.22 -43.2 96.2 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.802 2.041 . . . . 1.0 112.036 171.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.5 m -64.41 -43.05 95.62 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.355 -1.465 . . . . 1.0 114.182 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -65.08 -48.2 74.55 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.468 -1.395 . . . . 1.0 114.283 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -75.33 -43.22 51.86 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 115.505 1.669 . . . . 1.0 115.505 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -114.53 8.36 16.4 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 121.084 -1.01 . . . . 1.0 112.049 -163.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.88 3.43 90.53 Favored Glycine 0 CA--C 1.493 -1.288 0 N-CA-C 117.439 1.735 . . . . 1.0 117.439 159.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.55 155.27 40.23 Favored 'General case' 0 N--CA 1.434 -1.236 0 C-N-CA 125.741 1.616 . . . . 1.0 113.386 -174.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.9 m -102.19 124.93 48.64 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 120.378 -1.451 . . . . 1.0 109.144 175.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.2 ptm -60.95 -29.15 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.019 2.229 . . . . 1.0 117.019 -170.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.99 -15.54 60.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.16 -1.588 . . . . 1.0 114.218 176.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -97.32 -9.61 27.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.564 1.546 . . . . 1.0 112.287 -175.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.0 pt -120.88 143.99 31.27 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 C-N-CA 124.248 1.019 . . . . 1.0 109.597 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -135.92 154.92 50.97 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -113.93 148.54 36.66 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.484 -1.385 . . . . 1.0 109.745 -172.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -137.66 159.41 42.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 123.116 1.436 . . . . 1.0 111.927 177.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -133.25 117.42 17.36 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.177 -1.828 . . . . 1.0 107.992 170.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.7 t70 59.29 31.66 21.34 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 127.312 2.245 . . . . 1.0 113.238 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.48 2.7 88.17 Favored Glycine 0 N--CA 1.435 -1.393 0 O-C-N 119.955 -1.716 . . . . 1.0 114.646 -176.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -102.12 137.06 19.37 Favored Pre-proline 0 N--CA 1.435 -1.214 0 O-C-N 120.161 -1.788 . . . . 1.0 110.076 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -49.09 135.28 30.23 Favored 'Trans proline' 0 N--CA 1.442 -1.553 0 C-N-CA 124.547 3.498 . . . . 1.0 117.832 170.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 pt -121.89 142.49 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 108.244 -1.021 . . . . 1.0 108.244 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -97.65 167.61 10.86 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 121.143 -0.973 . . . . 1.0 110.922 -175.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -67.63 -19.92 65.28 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.444 -1.41 . . . . 1.0 112.684 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.6 m -99.43 2.0 44.69 Favored 'General case' 0 N--CA 1.436 -1.175 0 C-N-CA 126.764 2.026 . . . . 1.0 111.687 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -80.6 169.07 18.13 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 119.028 -2.295 . . . . 1.0 112.24 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.0 p -106.7 153.04 40.94 Favored Pre-proline 0 N--CA 1.438 -1.027 0 O-C-N 120.905 -1.122 . . . . 1.0 113.481 -157.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.05 -31.35 92.82 Favored 'Trans proline' 0 N--CA 1.44 -1.625 0 C-N-CA 123.374 2.716 . . . . 1.0 116.582 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.35 -45.83 78.84 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 114.029 1.122 . . . . 1.0 114.029 174.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.02 -41.3 82.36 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 125.661 1.584 . . . . 1.0 112.622 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 27.7 tp -87.19 -4.03 59.09 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 124.269 1.027 . . . . 1.0 111.601 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 56.85 44.42 23.29 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 126.554 1.942 . . . . 1.0 113.396 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 91.0 mtp -65.98 143.29 57.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.98 2.112 . . . . 1.0 115.148 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -157.56 179.58 9.1 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 105.837 -1.912 . . . . 1.0 105.837 -171.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.409 ' HA ' ' HB ' ' A' ' 18' ' ' ILE 0.3 6.7 p-10 -51.3 -26.52 7.58 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 128.511 2.724 . . . . 1.0 118.239 -178.279 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -137.78 67.45 1.42 Allowed 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 125.106 1.362 . . . . 1.0 110.638 173.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -78.38 162.68 26.26 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 119.342 -2.098 . . . . 1.0 114.409 179.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.6 m -135.39 123.64 23.12 Favored 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.36 1.064 . . . . 1.0 111.053 178.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 78.8 mt -108.0 140.54 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 C-N-CA 126.371 1.869 . . . . 1.0 108.841 174.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -110.97 140.12 45.74 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.612 -1.305 . . . . 1.0 108.562 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.6 t -108.53 139.07 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 O-C-N 120.559 -1.338 . . . . 1.0 109.959 -169.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -124.67 142.63 51.25 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 122.468 1.127 . . . . 1.0 110.059 173.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.7 pm0 -81.84 140.22 34.27 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.065 1.346 . . . . 1.0 111.851 -178.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.434 -1.251 0 O-C-N 120.618 -1.301 . . . . 1.0 109.971 -172.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 2.1 p . . . . . 0 CA--C 1.495 -1.172 0 CA-C-O 122.801 1.286 . . . . 1.0 111.301 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 3.6 mt -113.13 120.32 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 C-N-CA 125.092 1.357 . . . . 1.0 109.719 162.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.0 140.29 36.49 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 105.032 -2.21 . . . . 1.0 105.032 164.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 N--CA 1.438 -1.053 0 CA-C-N 122.668 2.485 . . . . 1.0 116.754 -175.141 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.435 -1.196 0 N-CA-C 116.005 1.854 . . . . 1.0 116.005 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.9 pt -143.04 160.75 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 C-N-CA 128.368 2.667 . . . . 1.0 107.545 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -117.66 144.85 44.83 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.143 -2.223 . . . . 1.0 108.422 174.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -127.19 150.56 49.47 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 119.835 -1.791 . . . . 1.0 107.541 173.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -115.31 148.94 38.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 119.667 -1.895 . . . . 1.0 110.883 171.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.4 t -119.45 123.52 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.54 -1.652 . . . . 1.0 106.54 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.03 130.1 53.64 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.639 1.209 . . . . 1.0 112.188 -173.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.572 0 CA-C-O 122.928 1.293 . . . . 1.0 113.561 177.708 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.434 -1.244 0 N-CA-C 109.942 -0.392 . . . . 1.0 109.942 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.265 0.6 OUTLIER -129.15 138.76 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 O-C-N 119.888 -1.757 . . . . 1.0 110.571 166.477 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.13 149.21 41.43 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-O 124.199 1.952 . . . . 1.0 113.807 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.44 140.71 37.41 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.724 -1.86 . . . . 1.0 107.771 -162.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HZ3' ' CG ' ' B' ' 968' ' ' ASP . 12.5 ttpt -103.88 115.87 31.24 Favored 'General case' 0 CA--C 1.493 -1.232 0 C-N-CA 126.304 1.842 . . . . 1.0 111.697 -175.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 11.0 tt -143.04 154.77 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.388 0 CA-C-O 124.917 2.294 . . . . 1.0 109.943 -152.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -115.03 153.6 30.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 111.716 -2.493 . . . . 1.0 110.26 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.01 -38.08 89.74 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 115.916 1.821 . . . . 1.0 115.916 -158.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -87.06 10.01 17.91 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.916 -1.115 . . . . 1.0 113.945 175.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.4 m -91.8 121.77 66.53 Favored Pre-proline 0 N--CA 1.437 -1.105 0 O-C-N 119.409 -2.057 . . . . 1.0 108.265 177.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.08 158.2 49.19 Favored 'Trans proline' 0 N--CA 1.441 -1.617 0 C-N-CA 123.13 2.554 . . . . 1.0 115.569 -175.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.448 1.5 pp -63.23 -25.66 68.43 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 115.183 1.549 . . . . 1.0 115.183 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.6 p -52.68 -29.06 24.49 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 120.37 -1.456 . . . . 1.0 114.469 170.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.24 -43.13 71.21 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 119.819 -1.801 . . . . 1.0 112.923 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.09 69.7 Favored 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 120.452 -1.405 . . . . 1.0 113.376 172.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.51 -43.53 98.7 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.433 -1.417 . . . . 1.0 113.289 174.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -42.57 98.6 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.686 -1.259 . . . . 1.0 113.596 170.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.23 86.76 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.21 -43.74 95.71 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 126.005 1.722 . . . . 1.0 111.695 175.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.5 m -62.5 -42.58 99.59 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.86 1.264 . . . . 1.0 114.077 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -64.57 -46.22 83.69 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 120.206 -1.558 . . . . 1.0 114.382 174.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -78.38 -43.2 28.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 116.078 1.881 . . . . 1.0 116.078 -178.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.0 mm100 -113.64 4.98 16.31 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 121.509 -0.744 . . . . 1.0 111.84 -166.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.38 84.1 Favored Glycine 0 CA--C 1.494 -1.251 0 N-CA-C 118.655 2.222 . . . . 1.0 118.655 161.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.5 mt -85.02 164.67 18.11 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 121.187 -1.184 . . . . 1.0 113.841 -172.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.9 m -102.2 135.68 43.37 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.394 -1.441 . . . . 1.0 110.709 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.2 mtp -61.82 -38.71 89.18 Favored 'General case' 0 CA--C 1.495 -1.153 0 C-N-CA 125.887 1.675 . . . . 1.0 114.308 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 ptt-85 -92.67 0.73 57.47 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 125.098 1.359 . . . . 1.0 112.751 -175.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mm-40 -92.73 -24.52 18.56 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.61 -1.306 . . . . 1.0 111.002 175.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.1 pt -120.35 149.34 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 O-C-N 120.972 -1.08 . . . . 1.0 110.82 -174.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -134.41 154.97 51.09 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 107.872 -1.159 . . . . 1.0 107.872 168.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -106.51 148.6 28.02 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 -175.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -142.26 155.36 45.23 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 114.834 1.42 . . . . 1.0 114.834 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -115.19 107.45 15.31 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 106.948 -1.501 . . . . 1.0 106.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.2 t70 52.71 33.32 13.66 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 114.84 1.422 . . . . 1.0 114.84 175.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.49 5.78 89.16 Favored Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 118.755 2.262 . . . . 1.0 118.755 -177.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -123.63 152.83 66.0 Favored Pre-proline 0 N--CA 1.436 -1.145 0 CA-C-O 111.748 -3.977 . . . . 1.0 103.887 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.786 57.9 Cg_exo 71.97 155.76 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.827 2 C-N-CA 111.555 -5.163 . . . . 1.0 116.871 169.535 . . . . . . . . 3 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.295 5.9 pt -123.91 159.24 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 1 C-N-CA 135.01 5.324 . . . . 1.0 111.136 17.769 . . . . . . . . 3 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -102.82 163.02 12.46 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 120.816 1.644 . . . . 1.0 110.62 172.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.98 -34.63 75.08 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 119.102 -2.248 . . . . 1.0 115.257 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.4 m -92.03 8.53 37.28 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.5 1.12 . . . . 1.0 111.882 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -81.8 172.74 13.0 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.302 -2.124 . . . . 1.0 108.88 163.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 47.7 p -147.03 159.69 42.17 Favored Pre-proline 0 CA--C 1.498 -1.056 0 O-C-N 119.186 -2.196 . . . . 1.0 111.985 -163.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -59.4 -32.17 96.07 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.602 2.868 . . . . 1.0 115.674 168.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.38 -46.08 81.52 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 119.293 0.951 . . . . 1.0 113.154 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -69.22 -41.39 77.1 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 125.507 1.523 . . . . 1.0 113.605 -177.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -79.94 -8.41 59.31 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.661 -1.275 . . . . 1.0 112.805 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.12 46.87 7.72 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 126.124 1.77 . . . . 1.0 113.753 -178.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.0 mtt -62.26 153.78 29.64 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 126.767 2.027 . . . . 1.0 114.047 173.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.59 -179.9 3.93 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.172 0.989 . . . . 1.0 109.277 -171.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -57.3 -26.6 61.13 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 127.155 2.182 . . . . 1.0 116.007 -175.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -136.54 91.37 2.65 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 107.785 -1.191 . . . . 1.0 107.785 161.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.42 161.43 19.43 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.97 -1.706 . . . . 1.0 112.418 173.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.3 m -130.17 115.3 16.82 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 122.224 1.012 . . . . 1.0 110.742 -177.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 140.68 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 126.841 2.056 . . . . 1.0 108.363 -172.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -110.97 151.35 28.04 Favored 'General case' 0 N--CA 1.433 -1.279 0 O-C-N 120.008 -1.682 . . . . 1.0 110.272 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.0 t -108.66 139.56 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 O-C-N 121.026 -1.046 . . . . 1.0 110.29 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -132.43 139.78 48.16 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-O 122.102 0.953 . . . . 1.0 110.036 165.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -87.85 141.21 28.77 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 124.476 1.11 . . . . 1.0 111.482 -175.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 . . . . . 0 N--CA 1.434 -1.242 0 C-N-CA 124.641 1.176 . . . . 1.0 113.101 -177.296 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER . . . . . 0 N--CA 1.436 -1.148 0 N-CA-C 114.728 1.381 . . . . 1.0 114.728 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -107.82 120.13 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.21 0 N-CA-C 107.094 -1.447 . . . . 1.0 107.094 -172.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . 0.435 ' CG ' ' HZ3' ' A' ' 33' ' ' LYS . 10.9 t0 -102.17 116.9 33.63 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.204 -1.56 . . . . 1.0 107.14 164.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.496 -1.108 0 CA-C-N 120.346 1.43 . . . . 1.0 114.851 -175.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.6 p80 . . . . . 0 N--CA 1.434 -1.227 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.7 pt -135.25 160.65 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 131.213 3.805 . . . . 1.0 106.847 -175.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -113.86 144.9 42.26 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 118.818 -2.426 . . . . 1.0 110.832 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.33 157.62 46.36 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.476 -2.64 . . . . 1.0 105.687 175.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -119.99 150.66 40.17 Favored 'General case' 0 N--CA 1.434 -1.226 0 C-N-CA 127.32 2.248 . . . . 1.0 112.654 171.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.83 132.37 54.32 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.188 0 N-CA-C 106.242 -1.762 . . . . 1.0 106.242 169.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.66 130.15 56.18 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 121.467 0.651 . . . . 1.0 109.479 169.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.372 0 C-N-CA 124.774 1.178 . . . . 1.0 114.69 -176.966 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.436 -1.156 0 CA-C-O 121.933 0.873 . . . . 1.0 111.398 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.474 ' CG1' ' CE1' ' A' ' 32' ' ' PHE . 0.6 OUTLIER -129.14 138.71 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.243 -1.536 . . . . 1.0 107.852 168.279 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.485 ' H ' HG22 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -114.8 158.06 22.4 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 126.538 3.066 . . . . 1.0 113.49 172.504 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.474 ' CE1' ' CG1' ' A' ' 30' ' ' VAL 0.271 25.6 m-85 -145.11 148.23 33.41 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 118.218 -2.801 . . . . 1.0 109.214 -159.575 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -116.51 115.7 26.26 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 120.496 1.498 . . . . 1.0 112.965 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.465 ' CG1' ' H ' ' A' ' 35' ' ' LYS . 20.9 tt -150.9 154.75 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 125.665 2.65 . . . . 1.0 111.538 -164.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.465 ' H ' ' CG1' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -93.69 163.01 13.71 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 110.983 -2.826 . . . . 1.0 111.731 -172.956 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -69.94 -37.11 75.78 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 117.582 2.438 . . . . 1.0 117.582 -162.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -88.44 -24.32 23.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.401 -1.437 . . . . 1.0 113.174 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m -60.68 137.08 92.94 Favored Pre-proline 0 N--CA 1.438 -1.073 0 C-N-CA 126.544 1.938 . . . . 1.0 114.037 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -76.54 157.2 36.38 Favored 'Trans proline' 0 N--CA 1.441 -1.568 0 CA-C-N 123.76 2.378 . . . . 1.0 115.235 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.319 1.4 pp -62.84 -25.71 68.4 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 125.341 1.456 . . . . 1.0 114.643 179.055 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.0 t -52.8 -29.08 25.57 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.663 -1.898 . . . . 1.0 115.216 170.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -45.58 66.57 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.01 -1.681 . . . . 1.0 111.039 -170.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.468 ' HB2' ' CD1' ' A' ' 32' ' ' PHE 0.332 0.0 OUTLIER -65.81 -36.5 83.67 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 115.151 1.537 . . . . 1.0 115.151 171.465 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.1 tpp -62.27 -40.66 96.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 114.738 1.385 . . . . 1.0 114.738 177.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -65.7 -41.11 92.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 O-C-N 120.054 -1.654 . . . . 1.0 112.793 171.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.89 -37.14 83.48 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.697 -1.252 . . . . 1.0 114.078 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.39 -44.94 89.16 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.189 -1.569 . . . . 1.0 112.427 171.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.6 m -61.75 -39.96 93.45 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 124.126 0.97 . . . . 1.0 113.184 175.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -66.29 -47.82 72.37 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.5 1.12 . . . . 1.0 113.86 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -69.03 -43.32 74.96 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.383 -1.448 . . . . 1.0 114.621 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.2 mm100 -114.19 8.47 16.87 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 114.302 1.223 . . . . 1.0 114.302 -163.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.03 42.23 12.68 Favored Glycine 0 CA--C 1.494 -1.264 0 N-CA-C 116.355 1.302 . . . . 1.0 116.355 163.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 30.5 mt -116.63 162.87 16.97 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 121.176 -1.191 . . . . 1.0 110.165 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 55.0 m -102.36 132.55 48.27 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.535 -1.353 . . . . 1.0 110.019 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.8 tpt -61.78 -40.67 96.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 126.145 1.778 . . . . 1.0 114.229 -166.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -97.62 13.21 30.93 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.708 -1.245 . . . . 1.0 112.131 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -105.93 -7.51 18.14 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 124.22 1.008 . . . . 1.0 111.34 171.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.4 pt -111.76 136.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 O-C-N 121.095 -1.003 . . . . 1.0 110.015 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.1 mmt180 -123.79 139.03 54.38 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.709 -1.244 . . . . 1.0 109.54 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.27 143.94 48.05 Favored 'General case' 0 N--CA 1.433 -1.323 0 O-C-N 120.675 -1.266 . . . . 1.0 111.48 -162.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -141.11 154.79 46.08 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 124.508 1.123 . . . . 1.0 110.445 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -133.62 117.92 17.61 Favored 'General case' 0 N--CA 1.433 -1.305 0 O-C-N 120.626 -1.296 . . . . 1.0 108.351 176.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 44.2 t0 51.62 45.05 28.7 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.117 1.767 . . . . 1.0 112.713 -175.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.2 0.96 72.78 Favored Glycine 0 N--CA 1.436 -1.349 0 N-CA-C 116.58 1.392 . . . . 1.0 116.58 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -112.64 128.92 24.94 Favored Pre-proline 0 N--CA 1.436 -1.125 0 O-C-N 120.027 -1.867 . . . . 1.0 110.728 -174.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -48.53 136.19 26.56 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 124.686 3.591 . . . . 1.0 117.952 170.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 4.3 pt -123.19 154.18 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.183 0 C-N-CA 125.36 1.464 . . . . 1.0 109.349 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -110.49 161.2 15.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 121.036 -1.04 . . . . 1.0 109.049 -171.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -65.88 -25.6 67.25 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 119.536 -1.978 . . . . 1.0 113.243 173.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 m -78.42 -18.4 55.03 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.531 1.932 . . . . 1.0 112.947 173.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -67.52 160.26 28.01 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-O 124.189 1.947 . . . . 1.0 112.495 174.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.3 p -144.31 162.22 40.85 Favored Pre-proline 0 CA--C 1.496 -1.133 0 CA-C-N 114.472 -1.24 . . . . 1.0 110.025 -158.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -60.56 -32.44 93.5 Favored 'Trans proline' 0 N--CA 1.439 -1.698 0 C-N-CA 123.2 2.6 . . . . 1.0 114.558 168.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.22 -45.73 83.52 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 122.264 1.03 . . . . 1.0 113.155 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -71.22 -44.36 65.53 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 124.735 1.214 . . . . 1.0 113.2 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -87.75 -8.35 56.14 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 113.568 0.951 . . . . 1.0 113.568 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.29 42.24 15.29 Favored 'General case' 0 N--CA 1.435 -1.214 0 C-N-CA 128.664 2.786 . . . . 1.0 115.901 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtm -69.61 154.24 42.29 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 126.861 2.065 . . . . 1.0 113.832 169.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -141.02 -175.09 4.18 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 105.919 -1.882 . . . . 1.0 105.919 -164.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.337 4.0 p-10 -50.45 -26.47 5.11 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 118.875 2.917 . . . . 1.0 118.875 -167.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -141.48 58.54 1.51 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.34 1.056 . . . . 1.0 113.062 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 169.35 16.87 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 119.005 -2.31 . . . . 1.0 116.821 -173.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.3 m -131.87 122.12 25.17 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 124.998 1.319 . . . . 1.0 112.182 -176.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 52.8 mt -112.91 140.73 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.061 0 C-N-CA 127.65 2.38 . . . . 1.0 108.132 175.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -110.95 134.28 52.7 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 120.66 -1.275 . . . . 1.0 108.615 -177.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.69 132.96 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 C-N-CA 125.328 1.451 . . . . 1.0 107.139 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -130.52 134.23 46.88 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.732 1.253 . . . . 1.0 110.956 177.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -88.05 140.25 29.68 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 124.988 1.315 . . . . 1.0 112.968 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 N--CA 1.434 -1.238 0 C-N-CA 126.017 1.727 . . . . 1.0 112.162 -172.78 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . 0.485 HG22 ' H ' ' A' ' 31' ' ' GLN . 2.2 t . . . . . 0 N--CA 1.437 -1.1 0 N-CA-C 113.391 0.886 . . . . 1.0 113.391 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -109.56 125.19 66.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 O-C-N 118.962 -2.337 . . . . 1.0 112.763 -146.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -99.37 125.05 44.98 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.12 2.168 . . . . 1.0 110.382 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 2.0 mm? . . . . . 0 N--CA 1.436 -1.136 0 N-CA-C 116.165 1.913 . . . . 1.0 116.165 -173.023 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.497 -1.058 0 N-CA-C 115.85 1.796 . . . . 1.0 115.85 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.6 pt -140.35 160.76 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 128.568 2.747 . . . . 1.0 105.832 175.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -109.44 144.75 37.24 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 118.838 -2.414 . . . . 1.0 107.995 168.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -137.38 147.76 45.72 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.613 -1.93 . . . . 1.0 106.988 175.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -116.83 150.59 38.12 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 125.6 1.56 . . . . 1.0 113.022 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.9 t -111.78 125.98 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.206 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 170.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.34 134.48 54.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 122.406 1.098 . . . . 1.0 112.593 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.398 0 O-C-N 120.744 -1.222 . . . . 1.0 111.319 177.022 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.4 t . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 109.195 -0.668 . . . . 1.0 109.195 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.18 138.73 53.69 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 O-C-N 120.236 -1.54 . . . . 1.0 110.383 169.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.12 145.05 50.12 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 123.183 1.468 . . . . 1.0 112.696 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . 0.342 0.5 OUTLIER -144.41 140.61 29.11 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.118 -1.614 . . . . 1.0 108.627 -158.274 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.323 35.6 ttpt -110.96 115.5 29.59 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 123.428 1.585 . . . . 1.0 112.037 -170.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.554 ' CD1' ' H ' ' A' ' 35' ' ' LYS . 4.6 tp -154.81 154.83 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 127.498 3.523 . . . . 1.0 112.624 -163.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.554 ' H ' ' CD1' ' A' ' 34' ' ' ILE . 11.4 mptt -64.12 142.88 58.25 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 109.414 -3.539 . . . . 1.0 113.685 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.9 ttt-85 -71.2 -28.48 64.25 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.168 -1.378 . . . . 1.0 113.516 -173.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -76.21 -29.84 57.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 115.648 1.721 . . . . 1.0 115.648 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 75.0 m -62.49 141.26 96.68 Favored Pre-proline 0 N--CA 1.439 -1.004 0 C-N-CA 127.425 2.29 . . . . 1.0 114.288 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -56.27 145.93 74.89 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 123.957 3.104 . . . . 1.0 116.797 174.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.291 1.3 pt? -63.74 -25.61 68.27 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 114.498 1.296 . . . . 1.0 114.498 172.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.8 t -52.64 -29.13 24.58 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 125.787 1.635 . . . . 1.0 114.62 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -65.77 -42.47 90.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.314 -2.116 . . . . 1.0 112.553 176.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.87 -41.58 99.44 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 126.441 1.896 . . . . 1.0 114.463 171.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 77.0 mtp -57.31 -45.9 83.75 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 113.578 0.955 . . . . 1.0 113.578 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -66.35 -40.2 89.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.456 -1.403 . . . . 1.0 113.044 173.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.34 83.41 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.563 -1.336 . . . . 1.0 114.054 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -61.58 -42.28 98.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 O-C-N 120.21 -1.556 . . . . 1.0 110.83 172.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.8 m -61.35 -46.34 90.65 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.135 1.532 . . . . 1.0 115.135 173.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -69.55 -49.85 50.47 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 115.873 1.805 . . . . 1.0 115.873 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -70.63 -38.18 73.88 Favored 'General case' 0 CA--C 1.493 -1.236 0 C-N-CA 125.632 1.573 . . . . 1.0 113.877 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.96 10.95 20.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 O-C-N 121.509 -0.745 . . . . 1.0 111.676 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.81 44.75 24.06 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.756 1.462 . . . . 1.0 116.756 161.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.2 mt -121.66 154.47 36.79 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 121.469 -1.019 . . . . 1.0 110.957 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.0 m -100.14 136.27 40.29 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 120.514 -1.366 . . . . 1.0 109.923 174.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.4 tpt -59.55 -35.05 73.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.86 2.064 . . . . 1.0 114.055 -176.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.445 ' H ' ' HG2' ' A' ' 56' ' ' ARG . 20.2 ptt-85 -90.0 4.15 51.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.203 1.801 . . . . 1.0 111.151 -174.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.02 -14.49 16.44 Favored 'General case' 0 N--CA 1.432 -1.367 0 O-C-N 121.024 -1.047 . . . . 1.0 111.854 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.6 pt -127.76 159.97 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 119.897 1.226 . . . . 1.0 112.282 -166.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -138.31 147.71 43.85 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.201 -1.037 . . . . 1.0 108.201 169.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -104.6 144.57 31.52 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 126.455 1.902 . . . . 1.0 107.438 -172.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.661 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 7.5 tmm_? -152.19 144.81 24.21 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 -167.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.661 ' CG ' ' HA ' ' A' ' 61' ' ' ARG 0.804 0.0 OUTLIER -123.1 142.63 50.67 Favored 'General case' 0 N--CA 1.408 -2.566 1 N-CA-C 94.606 -6.072 . . . . 1.0 94.606 -122.145 . . . . . . . . 5 4 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -69.83 74.68 0.44 Allowed 'General case' 0 N--CA 1.438 -1.038 0 O-C-N 119.747 -1.845 . . . . 1.0 115.434 -159.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.42 3.93 78.73 Favored Glycine 0 N--CA 1.433 -1.518 0 C-N-CA 127.639 2.542 . . . . 1.0 112.251 -159.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.602 ' O ' ' CB ' ' A' ' 62' ' ' PHE . 53.4 mt-30 -123.75 153.22 66.77 Favored Pre-proline 0 N--CA 1.428 -1.532 1 N-CA-C 99.719 -4.178 . . . . 1.0 99.719 -158.3 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.534 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 55.5 Cg_endo -72.12 135.97 26.1 Favored 'Trans proline' 0 N--CA 1.444 -1.406 1 C-N-CA 125.457 4.105 . . . . 1.0 116.295 148.22 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.554 HG12 ' HB3' ' A' ' 62' ' ' PHE . 5.8 pt -117.59 127.24 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.117 0 C-N-CA 126.897 2.079 . . . . 1.0 108.976 171.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -112.8 158.75 19.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 125.381 1.473 . . . . 1.0 108.772 175.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -59.99 -25.32 65.15 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 118.9 -2.375 . . . . 1.0 116.947 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 m -92.35 -2.27 56.49 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.622 -1.299 . . . . 1.0 111.351 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -73.18 171.81 12.28 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 119.311 -2.118 . . . . 1.0 111.988 172.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 64.9 p -146.34 154.41 49.37 Favored Pre-proline 0 CA--C 1.495 -1.141 0 O-C-N 120.097 -1.627 . . . . 1.0 109.415 -162.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -58.16 -31.64 93.8 Favored 'Trans proline' 0 N--CA 1.44 -1.672 0 C-N-CA 123.272 2.648 . . . . 1.0 116.078 170.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.09 89.99 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -74.35 -41.11 61.59 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.966 1.306 . . . . 1.0 113.306 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.78 -8.49 59.7 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 122.124 0.964 . . . . 1.0 112.665 178.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.289 42.2 mm-40 64.43 48.16 2.82 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 126.204 1.802 . . . . 1.0 114.416 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.2 mtt -82.05 154.25 25.72 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 127.03 2.132 . . . . 1.0 111.06 172.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -125.89 -178.98 4.47 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 121.062 -1.024 . . . . 1.0 109.396 -164.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.376 9.1 p-10 -54.1 -26.55 27.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 117.217 2.303 . . . . 1.0 117.217 -174.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -135.75 89.49 2.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 123.277 0.631 . . . . 1.0 111.366 158.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.7 170.53 10.06 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 116.765 2.135 . . . . 1.0 116.765 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.9 m -135.87 120.95 18.84 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 125.008 1.323 . . . . 1.0 112.473 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.8 mt -110.22 140.78 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.106 0 C-N-CA 129.972 3.309 . . . . 1.0 108.31 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -110.82 146.43 36.43 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.939 -1.726 . . . . 1.0 108.693 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.4 t -121.18 139.69 47.59 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.218 0 O-C-N 121.17 -0.956 . . . . 1.0 108.969 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -128.58 143.24 50.92 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 121.367 -0.833 . . . . 1.0 111.14 163.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -87.16 130.27 34.6 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.739 1.257 . . . . 1.0 112.76 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 . . . . . 0 N--CA 1.434 -1.248 0 C-N-CA 125.169 1.387 . . . . 1.0 111.147 -179.184 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 16.5 t . . . . . 0 CA--C 1.496 -1.134 0 CA-C-O 123.978 1.847 . . . . 1.0 114.012 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 6.5 mt -113.05 111.01 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 C-N-CA 127.127 2.171 . . . . 1.0 110.808 -171.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -102.18 109.08 20.67 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 119.172 -2.205 . . . . 1.0 112.703 171.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . 0.402 HD22 ' HB ' ' A' ' 34' ' ' ILE 0.275 0.4 OUTLIER . . . . . 0 CA--C 1.496 -1.115 0 CA-C-N 122.713 2.506 . . . . 1.0 114.433 -172.101 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 . . . . . 0 N--CA 1.437 -1.1 0 N-CA-C 115.511 1.671 . . . . 1.0 115.511 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -140.66 160.68 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 127.306 2.242 . . . . 1.0 109.158 -172.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -117.72 144.77 44.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 118.87 -2.393 . . . . 1.0 109.127 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -127.91 157.49 40.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 O-C-N 119.136 -2.227 . . . . 1.0 106.159 167.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -109.35 150.6 27.78 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 125.578 1.551 . . . . 1.0 110.539 161.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.4 t -116.94 124.93 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 171.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.06 130.13 51.66 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 122.654 1.216 . . . . 1.0 111.837 -176.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.472 0 CA-C-O 122.763 1.202 . . . . 1.0 115.727 -176.239 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.435 -1.223 0 CA-C-O 122.297 1.046 . . . . 1.0 113.26 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.24 138.81 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.07 0 O-C-N 119.776 -1.827 . . . . 1.0 109.637 160.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.96 139.5 52.37 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-O 123.163 1.459 . . . . 1.0 112.309 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.477 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.0 OUTLIER -145.05 142.57 29.84 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.412 -1.43 . . . . 1.0 113.949 -163.061 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.305 14.0 ttpt -109.34 115.71 30.48 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.696 1.236 . . . . 1.0 114.2 -167.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 14.0 tt -146.28 154.75 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.461 0 CA-C-O 126.183 2.897 . . . . 1.0 110.012 -152.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.5 mtpp -107.65 158.07 17.56 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 110.768 -2.923 . . . . 1.0 111.413 -171.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -68.96 -37.99 79.14 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 117.275 2.324 . . . . 1.0 117.275 -151.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -87.95 -12.08 45.66 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 120.683 -1.26 . . . . 1.0 113.658 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 94.6 m -60.1 144.28 87.17 Favored Pre-proline 0 N--CA 1.437 -1.077 0 C-N-CA 128.091 2.556 . . . . 1.0 114.315 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -65.66 148.9 87.51 Favored 'Trans proline' 0 N--CA 1.44 -1.647 0 CA-C-N 124.935 2.798 . . . . 1.0 116.04 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.477 ' HA ' HD21 ' A' ' 43' ' ' LEU 0.368 0.6 OUTLIER -64.06 -25.66 68.21 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 115.266 1.58 . . . . 1.0 115.266 169.354 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.1 t -52.49 -29.04 22.94 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 126.917 2.087 . . . . 1.0 112.603 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -67.5 -36.87 81.9 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.431 -1.418 . . . . 1.0 111.822 -178.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.477 HD21 ' HA ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -64.08 -42.25 97.02 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 125.036 1.335 . . . . 1.0 112.144 172.015 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 ttm -58.39 -43.14 88.41 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 113.96 1.096 . . . . 1.0 113.96 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.19 -41.97 94.02 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.258 1.023 . . . . 1.0 112.429 173.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -38.6 90.43 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.525 -1.359 . . . . 1.0 114.459 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -60.98 -41.28 96.15 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 126.37 1.868 . . . . 1.0 111.769 173.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.2 m -62.92 -45.11 94.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.802 -1.186 . . . . 1.0 113.987 171.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -64.52 -51.74 61.34 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 119.944 -1.723 . . . . 1.0 114.618 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -76.43 -43.27 40.91 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 115.028 1.492 . . . . 1.0 115.028 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.63 2.25 25.8 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 121.289 -0.882 . . . . 1.0 110.602 -166.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.54 7.94 85.54 Favored Glycine 0 CA--C 1.493 -1.316 0 N-CA-C 117.576 1.79 . . . . 1.0 117.576 164.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.1 mt -83.79 166.76 17.72 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 119.165 1.482 . . . . 1.0 113.577 -172.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 67.1 m -102.28 131.47 48.84 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.519 -1.363 . . . . 1.0 112.052 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.5 ptp -66.51 -30.38 70.69 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt85 -75.18 -18.51 60.15 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.187 -1.571 . . . . 1.0 113.54 175.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -93.85 -10.62 33.38 Favored 'General case' 0 N--CA 1.435 -1.216 0 O-C-N 120.874 -1.141 . . . . 1.0 112.812 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.6 pt -114.15 146.5 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 C-N-CA 124.233 1.013 . . . . 1.0 111.204 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -136.93 137.08 39.18 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.731 -1.231 . . . . 1.0 108.479 167.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -103.27 148.62 25.61 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.024 -1.048 . . . . 1.0 111.227 -174.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -138.7 162.09 35.54 Favored 'General case' 0 N--CA 1.433 -1.276 0 O-C-N 120.97 -1.081 . . . . 1.0 109.864 174.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -115.33 110.04 18.8 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.561 -0.903 . . . . 1.0 108.561 164.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.5 t0 41.29 55.65 3.28 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.303 2.241 . . . . 1.0 114.738 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 2.32 90.64 Favored Glycine 0 N--CA 1.435 -1.368 0 N-CA-C 117.691 1.836 . . . . 1.0 117.691 -176.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -109.87 119.64 47.01 Favored Pre-proline 0 N--CA 1.435 -1.175 0 CA-C-N 120.954 2.377 . . . . 1.0 110.786 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -46.61 136.98 15.8 Favored 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 124.525 3.483 . . . . 1.0 117.391 165.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 pt -123.26 153.56 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 C-N-CA 125.132 1.373 . . . . 1.0 107.878 177.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -112.6 162.15 16.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.612 -1.305 . . . . 1.0 110.747 -172.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -73.93 -15.25 61.13 Favored 'General case' 0 N--CA 1.436 -1.135 0 O-C-N 119.16 -2.212 . . . . 1.0 115.058 -176.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.8 m -95.16 -3.64 47.52 Favored 'General case' 0 N--CA 1.438 -1.066 0 O-C-N 120.606 -1.309 . . . . 1.0 111.65 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -73.1 169.98 15.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 118.22 -2.8 . . . . 1.0 111.369 169.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 53.2 p -148.32 160.52 36.65 Favored Pre-proline 0 CA--C 1.495 -1.146 0 O-C-N 119.707 -1.871 . . . . 1.0 110.125 -157.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -58.51 -34.52 98.85 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.301 2.667 . . . . 1.0 114.748 167.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.1 -45.99 75.55 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 114.118 1.155 . . . . 1.0 114.118 175.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -70.41 -39.06 74.68 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.115 1.366 . . . . 1.0 114.056 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.6 tp -86.9 -8.49 57.22 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 120.759 -1.213 . . . . 1.0 112.355 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.263 40.7 mt-10 61.97 43.86 8.74 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 126.64 1.976 . . . . 1.0 114.382 177.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.2 mtt -57.23 154.19 10.72 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 128.262 2.625 . . . . 1.0 113.052 167.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -116.99 -177.44 3.2 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 120.981 -1.074 . . . . 1.0 108.848 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.373 10.4 p-10 -57.74 -26.6 62.06 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 126.318 1.847 . . . . 1.0 115.636 -178.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -139.15 85.94 2.1 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.13 1.772 . . . . 1.0 110.344 166.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.28 165.37 16.5 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 120.432 -1.417 . . . . 1.0 113.807 175.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 69.5 m -132.01 121.37 23.79 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.216 1.406 . . . . 1.0 110.677 172.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.2 mm -115.55 140.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 C-N-CA 127.134 2.174 . . . . 1.0 109.315 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -111.16 139.83 46.22 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 120.193 -1.567 . . . . 1.0 111.97 -164.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.9 t -113.15 133.61 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 CA-C-O 122.766 1.27 . . . . 1.0 111.165 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.74 138.11 51.71 Favored 'General case' 0 N--CA 1.433 -1.279 0 CA-C-O 122.554 1.169 . . . . 1.0 110.651 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.7 mm100 -89.43 137.01 32.7 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 124.242 1.017 . . . . 1.0 111.195 -175.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 . . . . . 0 N--CA 1.433 -1.291 0 N-CA-C 115.219 1.562 . . . . 1.0 115.219 -174.969 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.435 -1.219 0 CA-C-O 123.494 1.616 . . . . 1.0 113.974 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . 0.477 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 7.0 mt -113.21 129.09 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 C-N-CA 127.454 2.302 . . . . 1.0 113.298 -165.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -102.08 129.59 48.46 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.292 -1.505 . . . . 1.0 108.174 167.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.437 -1.095 0 N-CA-C 117.919 2.563 . . . . 1.0 117.919 -170.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.5 m170 . . . . . 0 N--CA 1.437 -1.121 0 N-CA-C 112.618 0.599 . . . . 1.0 112.618 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 24.7 pt -143.03 160.65 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 126.394 1.877 . . . . 1.0 106.951 170.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -117.71 144.8 44.92 Favored 'General case' 0 N--CA 1.432 -1.33 0 O-C-N 119.3 -2.125 . . . . 1.0 108.982 176.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -127.5 146.04 50.64 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 119.938 -1.726 . . . . 1.0 107.455 168.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -106.45 150.62 25.89 Favored 'General case' 0 CA--C 1.493 -1.22 0 O-C-N 120.111 -1.618 . . . . 1.0 111.311 165.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.4 p -119.22 124.52 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 N-CA-C 107.106 -1.442 . . . . 1.0 107.106 172.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 130.2 49.07 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 123.083 1.42 . . . . 1.0 112.739 -171.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.442 0 CA-C-O 123.256 1.476 . . . . 1.0 115.801 -178.022 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.4 t . . . . . 0 N--CA 1.436 -1.157 0 CA-C-O 120.72 0.295 . . . . 1.0 110.922 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -128.04 137.88 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 N-CA-C 106.08 -1.822 . . . . 1.0 106.08 163.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.73 140.15 50.07 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-O 123.61 1.671 . . . . 1.0 111.269 161.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.467 ' CE2' ' HA ' ' A' ' 43' ' ' LEU 0.355 10.8 t80 -139.91 140.48 36.44 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 -155.141 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.279 27.3 ttpt -115.02 115.64 27.16 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-O 122.403 1.097 . . . . 1.0 111.013 -171.191 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.1 tt -140.09 154.7 23.46 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-O 124.216 1.96 . . . . 1.0 111.997 -155.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -100.24 157.3 16.69 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 123.282 1.515 . . . . 1.0 111.758 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 ttt-85 -71.25 -23.12 61.93 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 117.848 2.536 . . . . 1.0 117.848 -154.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -90.44 -19.68 23.62 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.039 -1.663 . . . . 1.0 112.438 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.5 m -60.9 140.45 93.62 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 126.33 1.852 . . . . 1.0 114.132 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -68.62 152.05 74.76 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 CA-C-N 124.052 2.483 . . . . 1.0 116.308 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.291 0.4 OUTLIER -69.06 -25.47 64.47 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 126.657 1.983 . . . . 1.0 112.41 168.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 89.9 p -52.69 -29.15 25.02 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.098 -2.251 . . . . 1.0 115.024 173.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -67.74 -36.07 79.88 Favored 'General case' 0 N--CA 1.427 -1.614 0 O-C-N 119.75 -1.844 . . . . 1.0 110.686 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.467 ' HA ' ' CE2' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -63.57 -41.94 98.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 127.553 2.341 . . . . 1.0 112.497 171.011 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 56.1 ttm -61.53 -44.49 96.96 Favored 'General case' 0 N--CA 1.433 -1.28 0 O-C-N 120.857 -1.152 . . . . 1.0 113.7 174.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -67.21 -40.08 86.4 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.226 -0.921 . . . . 1.0 112.747 176.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.99 -38.6 91.49 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.763 -1.21 . . . . 1.0 113.686 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -59.77 -40.11 87.1 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.218 1.807 . . . . 1.0 111.907 170.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.9 m -67.72 -44.4 77.74 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.629 -1.92 . . . . 1.0 114.489 172.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.42 -46.51 76.26 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.054 -1.654 . . . . 1.0 114.045 179.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 24.6 mtt180 -78.59 -42.19 29.71 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 116.572 2.064 . . . . 1.0 116.572 177.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.15 4.83 25.29 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.8 -1.187 . . . . 1.0 112.001 -166.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.11 5.72 85.46 Favored Glycine 0 N--CA 1.438 -1.22 0 N-CA-C 117.856 1.902 . . . . 1.0 117.856 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.15 165.5 20.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.916 -1.344 . . . . 1.0 113.748 -173.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -102.34 129.71 48.87 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.326 -1.484 . . . . 1.0 111.036 171.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -66.47 -22.52 66.2 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 119.835 -1.791 . . . . 1.0 115.464 -172.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -91.29 3.87 53.77 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 124.937 1.295 . . . . 1.0 112.513 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -112.91 -6.12 13.8 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 124.622 1.169 . . . . 1.0 112.4 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 31.6 pt -124.35 142.46 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.694 -1.253 . . . . 1.0 110.263 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -138.21 154.93 49.09 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 124.86 1.264 . . . . 1.0 108.159 172.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -116.04 148.71 39.9 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-O 123.028 1.394 . . . . 1.0 112.923 -167.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -136.3 152.55 50.81 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-O 122.421 1.105 . . . . 1.0 110.072 175.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -130.55 111.58 12.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.728 1.211 . . . . 1.0 108.733 -178.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.8 t70 48.63 44.85 21.42 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 126.409 1.883 . . . . 1.0 113.997 -174.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.5 1.69 88.96 Favored Glycine 0 N--CA 1.436 -1.323 0 N-CA-C 117.051 1.58 . . . . 1.0 117.051 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -109.96 137.7 20.56 Favored Pre-proline 0 N--CA 1.436 -1.175 0 CA-C-N 119.978 1.889 . . . . 1.0 110.365 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.74 144.99 36.05 Favored 'Trans proline' 0 N--CA 1.44 -1.659 0 C-N-CA 122.616 2.211 . . . . 1.0 112.466 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.0 pt -120.75 151.28 23.64 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.141 0 C-N-CA 124.644 1.177 . . . . 1.0 108.828 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -112.7 163.42 14.58 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.8 -1.188 . . . . 1.0 109.803 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -70.19 -13.94 62.41 Favored 'General case' 0 N--CA 1.436 -1.142 0 O-C-N 119.726 -1.859 . . . . 1.0 112.895 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.0 m -84.55 -11.84 55.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 125.948 1.699 . . . . 1.0 112.164 171.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -83.43 173.19 11.72 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.449 -2.032 . . . . 1.0 110.721 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 76.9 p -153.48 159.23 32.38 Favored Pre-proline 0 CA--C 1.498 -1.055 0 O-C-N 120.748 -1.22 . . . . 1.0 111.027 -161.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.87 -32.27 95.05 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 C-N-CA 123.616 2.877 . . . . 1.0 115.17 171.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.29 -46.03 78.37 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-O 122.54 1.162 . . . . 1.0 113.59 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -69.58 -40.77 76.53 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 125.424 1.49 . . . . 1.0 113.452 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 16.4 tp -87.74 -8.4 56.09 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.811 -1.18 . . . . 1.0 111.696 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 60.13 48.25 8.59 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 127.5 2.32 . . . . 1.0 114.443 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.66 151.29 25.25 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 127.169 2.188 . . . . 1.0 115.081 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -105.6 175.95 5.32 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.089 1.756 . . . . 1.0 110.518 -175.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -56.26 -26.59 52.18 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 126.297 1.839 . . . . 1.0 115.528 176.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.73 89.69 2.34 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 124.438 1.095 . . . . 1.0 108.826 163.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.86 169.68 12.33 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.187 -1.57 . . . . 1.0 114.283 174.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.9 m -130.84 118.07 20.25 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 124.809 1.243 . . . . 1.0 111.012 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 24.2 mm -105.74 140.56 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 127.575 2.35 . . . . 1.0 107.981 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -110.98 142.58 42.92 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 120.445 -1.409 . . . . 1.0 109.2 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.5 139.64 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 O-C-N 120.494 -1.379 . . . . 1.0 109.297 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -123.71 140.67 52.76 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.714 -1.217 . . . . 1.0 107.714 165.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -86.03 133.12 33.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 120.966 -1.084 . . . . 1.0 109.893 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 . . . . . 0 N--CA 1.434 -1.236 0 O-C-N 120.939 -1.101 . . . . 1.0 112.532 -163.632 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 42.0 t . . . . . 0 N--CA 1.435 -1.189 0 CA-C-O 123.765 1.745 . . . . 1.0 110.836 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 2.3 mt -113.12 118.43 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 C-N-CA 127.811 2.444 . . . . 1.0 111.432 -167.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -102.12 114.24 28.2 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.021 -1.674 . . . . 1.0 109.19 169.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.497 -1.07 0 CA-C-N 121.725 2.057 . . . . 1.0 115.476 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.2 p-80 . . . . . 0 N--CA 1.437 -1.106 0 N-CA-C 118.602 2.816 . . . . 1.0 118.602 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 pt -139.39 160.78 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 C-N-CA 129.43 3.092 . . . . 1.0 107.297 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -111.94 144.86 40.58 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 119.844 -1.785 . . . . 1.0 109.926 165.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.15 156.69 46.94 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 119.361 -2.087 . . . . 1.0 107.071 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 ptpt -125.37 150.67 47.0 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 126.363 1.865 . . . . 1.0 112.833 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -117.55 124.82 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 125.295 1.438 . . . . 1.0 107.88 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.9 130.19 51.87 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-O 122.613 1.196 . . . . 1.0 113.418 -176.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.386 0 C-N-CA 124.823 1.201 . . . . 1.0 113.349 173.945 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.435 -1.179 0 CA-C-O 121.612 0.72 . . . . 1.0 111.973 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -129.17 138.72 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 O-C-N 120.619 -1.301 . . . . 1.0 109.923 176.069 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.75 146.56 46.92 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 124.025 1.869 . . . . 1.0 114.619 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.61 146.39 47.86 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.857 -1.777 . . . . 1.0 107.952 -163.03 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.255 37.5 ttpt -112.04 115.76 29.44 Favored 'General case' 0 CA--C 1.494 -1.188 0 O-C-N 120.482 -1.386 . . . . 1.0 111.822 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.98 154.58 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-O 124.24 1.971 . . . . 1.0 110.972 -160.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.31 158.97 19.55 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.608 -2.087 . . . . 1.0 112.625 -176.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ttt-85 -71.31 -38.02 71.77 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 115.817 1.784 . . . . 1.0 115.817 -161.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -91.06 -16.61 27.6 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.769 -1.207 . . . . 1.0 113.571 -178.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 63.8 m -63.37 138.18 97.28 Favored Pre-proline 0 N--CA 1.437 -1.117 0 C-N-CA 125.331 1.452 . . . . 1.0 112.566 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -65.74 156.27 64.85 Favored 'Trans proline' 0 N--CA 1.44 -1.66 0 CA-C-N 124.023 2.473 . . . . 1.0 116.306 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.422 1.8 pp -61.39 -25.62 67.3 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 126.317 1.847 . . . . 1.0 114.006 172.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 93.2 p -52.58 -29.02 23.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.944 -1.722 . . . . 1.0 114.879 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -42.66 77.4 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.5 -2.0 . . . . 1.0 112.73 -174.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.14 -35.44 80.48 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.362 -1.461 . . . . 1.0 113.208 170.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.9 ttt -61.42 -41.75 97.66 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.193 -1.567 . . . . 1.0 114.805 173.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.96 -43.03 99.69 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 125.761 1.624 . . . . 1.0 111.989 172.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.73 81.95 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 174.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -59.79 -43.42 94.44 Favored 'General case' 0 N--CA 1.437 -1.112 0 C-N-CA 126.213 1.805 . . . . 1.0 111.662 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.5 m -60.39 -43.41 96.68 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 125.249 1.419 . . . . 1.0 114.174 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.75 -51.55 54.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 114.99 1.478 . . . . 1.0 114.99 174.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -42.29 59.3 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.761 -1.212 . . . . 1.0 113.749 -172.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -112.33 0.47 15.7 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 113.053 0.76 . . . . 1.0 113.053 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 41.46 28.52 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 118.093 1.997 . . . . 1.0 118.093 163.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.4 mt -121.58 168.02 12.22 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.282 1.433 . . . . 1.0 111.215 -171.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 t -102.22 133.04 47.74 Favored 'General case' 0 N--CA 1.436 -1.149 0 O-C-N 120.502 -1.374 . . . . 1.0 112.927 176.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 23.8 ptp -66.55 -18.57 65.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.397 1.628 . . . . 1.0 115.397 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -96.59 1.52 51.33 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.613 -1.304 . . . . 1.0 113.061 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -110.37 -31.5 7.27 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 119.722 -1.861 . . . . 1.0 111.769 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.2 pp -115.27 135.25 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 O-C-N 121.615 -0.678 . . . . 1.0 110.661 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -132.75 154.93 49.74 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.137 -1.602 . . . . 1.0 111.329 -171.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -104.17 148.66 26.04 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.297 -1.502 . . . . 1.0 113.055 -166.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -147.34 145.1 29.2 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 125.079 1.352 . . . . 1.0 108.213 -171.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -129.97 110.29 11.55 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 120.615 -1.303 . . . . 1.0 109.026 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 52.57 47.15 25.31 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.757 2.023 . . . . 1.0 114.038 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.93 4.89 86.39 Favored Glycine 0 N--CA 1.435 -1.416 0 O-C-N 120.371 -1.456 . . . . 1.0 116.289 -176.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -114.6 132.2 22.99 Favored Pre-proline 0 N--CA 1.434 -1.238 0 CA-C-N 120.386 2.093 . . . . 1.0 109.08 -177.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.63 135.26 34.05 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 123.869 3.046 . . . . 1.0 115.797 163.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 4.7 pt -119.66 142.85 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 105.943 -1.873 . . . . 1.0 105.943 174.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -100.14 158.25 15.99 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.796 -1.19 . . . . 1.0 108.574 -169.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -66.12 -26.0 67.25 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 119.382 -2.074 . . . . 1.0 113.569 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.3 m -78.48 -12.63 60.02 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 126.215 1.806 . . . . 1.0 113.213 171.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.94 172.64 11.9 Favored 'General case' 0 N--CA 1.432 -1.343 0 O-C-N 118.663 -2.523 . . . . 1.0 111.711 174.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 54.4 p -148.11 160.83 36.39 Favored Pre-proline 0 CA--C 1.495 -1.143 0 O-C-N 120.094 -1.629 . . . . 1.0 109.24 -159.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 99.7 Cg_exo -55.83 -36.14 94.9 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.275 2.65 . . . . 1.0 115.909 164.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.45 -45.7 82.72 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 114.124 1.157 . . . . 1.0 114.124 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -71.66 -43.16 66.55 Favored 'General case' 0 N--CA 1.433 -1.299 0 C-N-CA 124.694 1.197 . . . . 1.0 111.886 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -4.56 56.41 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.81 0.814 . . . . 1.0 111.754 -175.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.267 51.2 mt-10 60.02 48.33 8.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 C-N-CA 127.129 2.172 . . . . 1.0 115.106 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.9 mtt -73.64 153.6 40.08 Favored 'General case' 0 N--CA 1.432 -1.335 0 C-N-CA 126.653 1.981 . . . . 1.0 111.675 173.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.594 ' HG3' ' H ' ' A' ' 81' ' ' GLU . 10.7 pt-20 -118.14 178.7 4.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 O-C-N 120.568 -1.333 . . . . 1.0 110.606 -168.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.259 9.6 p-10 -52.92 -26.55 15.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.987 2.515 . . . . 1.0 116.556 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.594 ' H ' ' HG3' ' A' ' 79' ' ' GLU . 50.9 mt-10 -136.61 66.32 1.48 Allowed 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 125.12 1.368 . . . . 1.0 111.854 167.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.73 167.35 19.22 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 116.966 2.21 . . . . 1.0 116.966 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.4 m -127.63 125.38 40.07 Favored 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 126.17 1.788 . . . . 1.0 112.121 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 73.9 mt -114.33 140.76 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 C-N-CA 129.233 3.013 . . . . 1.0 109.172 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -110.9 141.48 44.26 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.965 1.706 . . . . 1.0 106.597 -171.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.7 t -108.54 131.6 58.68 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.257 0 O-C-N 120.783 -1.198 . . . . 1.0 108.82 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -118.46 135.31 54.44 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 123.456 1.598 . . . . 1.0 111.822 164.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.14 140.5 29.4 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 125.414 1.486 . . . . 1.0 111.816 -172.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 . . . . . 0 N--CA 1.435 -1.222 0 O-C-N 121.077 -1.014 . . . . 1.0 111.67 -178.605 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.292 0.2 OUTLIER . . . . . 0 N--CA 1.435 -1.222 0 N-CA-C 116.381 1.993 . . . . 1.0 116.381 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -113.05 115.22 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 124.573 1.149 . . . . 1.0 109.276 -168.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -102.16 122.94 45.13 Favored 'General case' 0 N--CA 1.434 -1.237 0 O-C-N 120.139 -1.6 . . . . 1.0 110.364 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 N--CA 1.435 -1.182 0 O-C-N 120.167 -1.583 . . . . 1.0 114.989 -175.001 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.3 mmt . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 119.9 -0.095 . . . . 1.0 111.144 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.26 -8.31 51.29 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.566 -1.334 . . . . 1.0 111.896 174.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -78.77 159.36 27.94 Favored 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 127.635 2.374 . . . . 1.0 113.801 177.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -93.61 130.56 39.47 Favored 'General case' 0 N--CA 1.433 -1.294 0 O-C-N 120.579 -1.326 . . . . 1.0 109.545 174.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -91.82 129.51 41.94 Favored Pre-proline 0 N--CA 1.435 -1.207 0 O-C-N 120.38 -1.45 . . . . 1.0 112.154 -176.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -53.34 155.93 11.64 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 124.401 3.401 . . . . 1.0 116.425 165.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -157.32 11.18 0.21 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 113.313 0.857 . . . . 1.0 113.313 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.5 120.62 12.04 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 119.908 -1.745 . . . . 1.0 114.277 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.18 5.78 88.68 Favored Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 124.667 1.127 . . . . 1.0 115.682 -175.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.1 t -106.52 117.7 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.105 0 CA-C-N 119.046 1.423 . . . . 1.0 109.022 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -75.81 -47.3 26.28 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-O 123.434 1.588 . . . . 1.0 113.395 -178.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 20.8 p -142.51 142.27 32.23 Favored 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 125.913 1.685 . . . . 1.0 108.949 -175.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -104.25 125.26 50.37 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 121.334 -0.854 . . . . 1.0 109.766 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . 0.307 0.5 OUTLIER 13.22 91.88 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 120.406 3.484 . . . . 1.0 120.406 174.504 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.9 t30 79.85 40.76 0.08 Allowed 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 126.921 2.088 . . . . 1.0 111.893 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 83.93 27.25 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 C-N-CA 126.669 1.987 . . . . 1.0 112.859 161.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -81.76 133.34 35.33 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.544 -1.347 . . . . 1.0 112.609 173.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.403 ' HB ' ' HA ' ' A' ' 80' ' ' ASP . 22.9 pt -143.03 160.72 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 C-N-CA 131.29 3.836 . . . . 1.0 106.541 -174.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -116.05 144.85 43.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.769 -2.457 . . . . 1.0 110.566 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -132.25 157.2 44.97 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 119.375 -2.078 . . . . 1.0 106.084 173.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -122.25 150.0 42.91 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 120.009 -1.682 . . . . 1.0 110.456 168.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.46 126.05 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.01 130.21 53.1 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 122.876 1.322 . . . . 1.0 112.114 -176.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.16 178.84 50.98 Favored Glycine 0 N--CA 1.433 -1.505 0 CA-C-O 123.351 1.528 . . . . 1.0 115.133 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -64.94 -33.6 76.42 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 125.882 1.673 . . . . 1.0 111.445 173.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -90.44 7.49 38.5 Favored 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 125.935 1.694 . . . . 1.0 112.937 -174.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.86 9.4 85.47 Favored Glycine 0 N--CA 1.436 -1.309 0 O-C-N 120.526 -1.359 . . . . 1.0 115.305 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.3 m -86.37 132.73 33.89 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 121.418 -1.048 . . . . 1.0 110.425 176.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -139.84 133.81 36.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.13 0 C-N-CA 124.232 1.013 . . . . 1.0 112.782 -167.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.19 138.78 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.067 0 O-C-N 120.566 -1.334 . . . . 1.0 110.178 170.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.07 158.49 16.39 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 123.406 1.574 . . . . 1.0 112.687 174.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -145.03 152.49 40.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.725 -1.125 . . . . 1.0 108.099 -173.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -124.12 118.3 26.6 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.768 -1.568 . . . . 1.0 106.768 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.412 ' CG1' ' H ' ' A' ' 35' ' ' LYS . 12.7 tt -144.49 154.83 14.84 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 C-N-CA 128.247 2.619 . . . . 1.0 111.113 -154.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.412 ' H ' ' CG1' ' A' ' 34' ' ' ILE . 1.5 mppt? -102.09 157.11 17.12 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 112.054 -2.339 . . . . 1.0 112.118 -177.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.09 -37.97 78.73 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 115.816 1.784 . . . . 1.0 115.816 -158.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -82.77 -17.97 42.32 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 114.344 1.238 . . . . 1.0 114.344 176.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 31.9 m -61.59 131.75 92.8 Favored Pre-proline 0 N--CA 1.438 -1.032 0 C-N-CA 125.479 1.511 . . . . 1.0 112.148 -175.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.78 157.08 62.96 Favored 'Trans proline' 0 N--CA 1.441 -1.606 0 CA-C-N 124.881 2.779 . . . . 1.0 114.914 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.433 2.7 pp -61.98 -25.55 67.69 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 124.958 1.303 . . . . 1.0 114.484 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.0 p -52.67 -29.02 24.2 Favored 'General case' 0 N--CA 1.435 -1.218 0 O-C-N 119.803 -1.811 . . . . 1.0 114.897 171.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -44.17 65.43 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 119.754 -1.841 . . . . 1.0 111.521 -175.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -35.58 80.0 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.898 -1.126 . . . . 1.0 111.957 175.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 ttm -61.65 -42.09 98.42 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 119.778 -1.826 . . . . 1.0 114.11 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 ttpt -69.14 -37.17 78.15 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.147 -1.595 . . . . 1.0 112.503 175.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.65 83.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 114.238 1.199 . . . . 1.0 114.238 171.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -59.13 -43.31 91.97 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.911 -1.743 . . . . 1.0 111.897 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 81.2 m -62.53 -42.46 99.54 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 125.009 1.323 . . . . 1.0 113.769 175.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.14 -48.89 78.08 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 124.594 1.157 . . . . 1.0 113.754 175.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -78.57 -43.16 27.25 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 114.85 1.426 . . . . 1.0 114.85 -174.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -114.16 9.59 17.18 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.934 -1.104 . . . . 1.0 112.793 -165.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.08 46.99 8.75 Favored Glycine 0 CA--C 1.493 -1.281 0 N-CA-C 117.67 1.828 . . . . 1.0 117.67 161.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.7 mt -125.59 160.95 28.32 Favored 'General case' 0 N--CA 1.436 -1.167 0 C-N-CA 124.566 1.147 . . . . 1.0 109.825 -170.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 m -102.28 133.81 46.59 Favored 'General case' 0 CA--C 1.496 -1.118 0 O-C-N 120.295 -1.503 . . . . 1.0 110.218 172.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -63.74 -32.59 74.13 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 116.527 2.047 . . . . 1.0 116.527 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -78.99 -14.71 59.04 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.19 -1.569 . . . . 1.0 114.024 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -87.73 -16.83 33.14 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.882 -1.136 . . . . 1.0 112.616 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.1 pt -116.37 140.47 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 O-C-N 120.814 -1.179 . . . . 1.0 108.987 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -138.21 146.33 42.49 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 107.265 -1.383 . . . . 1.0 107.265 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.1 m-30 -107.15 148.58 28.66 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.505 1.145 . . . . 1.0 110.663 -170.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -131.98 153.95 49.81 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 124.844 1.258 . . . . 1.0 109.346 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -126.12 108.69 11.57 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 165.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 48.71 50.49 17.21 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.098 2.159 . . . . 1.0 115.371 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.62 6.57 89.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 116.186 1.234 . . . . 1.0 116.186 -177.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -110.62 127.67 26.58 Favored Pre-proline 0 N--CA 1.435 -1.199 0 CA-C-N 119.564 1.682 . . . . 1.0 109.411 176.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -56.13 135.23 68.84 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 123.237 2.624 . . . . 1.0 115.54 166.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.4 pt -119.29 137.6 52.69 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 106.236 -1.764 . . . . 1.0 106.236 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -112.67 163.83 14.08 Favored 'General case' 0 N--CA 1.435 -1.206 0 O-C-N 120.717 -1.239 . . . . 1.0 108.433 -162.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -61.44 -28.3 69.17 Favored 'General case' 0 CA--C 1.497 -1.092 0 O-C-N 118.98 -2.325 . . . . 1.0 115.731 -175.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.1 m -78.51 -13.93 59.6 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 126.086 1.754 . . . . 1.0 112.459 175.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -75.89 168.93 19.12 Favored 'General case' 0 N--CA 1.432 -1.357 0 O-C-N 119.627 -1.92 . . . . 1.0 111.363 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p -151.43 161.72 28.83 Favored Pre-proline 0 CA--C 1.497 -1.081 0 O-C-N 119.878 -1.764 . . . . 1.0 111.047 -154.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -60.4 -31.69 92.98 Favored 'Trans proline' 0 N--CA 1.44 -1.649 0 C-N-CA 123.6 2.867 . . . . 1.0 115.417 168.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.87 -45.5 70.85 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 122.508 1.147 . . . . 1.0 112.65 173.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -70.48 -42.81 70.89 Favored 'General case' 0 N--CA 1.433 -1.295 0 C-N-CA 125.501 1.521 . . . . 1.0 113.729 -177.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 25.9 tp -85.82 -8.46 58.08 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.557 -1.339 . . . . 1.0 113.008 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 67.39 42.63 2.15 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.549 1.539 . . . . 1.0 113.608 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 63.9 mtt -62.3 148.73 44.11 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 127.065 2.146 . . . . 1.0 115.184 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -91.53 176.48 6.53 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.472 1.509 . . . . 1.0 111.431 -178.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' A' ' 18' ' ' ILE 0.259 12.1 p-10 -58.16 -26.39 62.66 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.437 2.295 . . . . 1.0 114.477 168.049 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -138.26 79.15 1.72 Allowed 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 125.35 1.46 . . . . 1.0 109.686 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.68 162.44 21.82 Favored 'General case' 0 N--CA 1.437 -1.094 0 O-C-N 120.021 -1.674 . . . . 1.0 112.483 176.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.8 m -131.21 118.57 20.62 Favored 'General case' 0 CA--C 1.496 -1.11 0 C-N-CA 124.297 1.039 . . . . 1.0 110.332 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mm -119.18 140.6 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 C-N-CA 126.828 2.051 . . . . 1.0 108.937 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -111.05 149.45 30.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.281 -1.512 . . . . 1.0 110.989 -170.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.0 t -115.76 139.63 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 O-C-N 120.665 -1.272 . . . . 1.0 110.625 -174.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -121.63 142.87 49.7 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.426 -0.953 . . . . 1.0 108.426 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -89.56 120.29 30.73 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 120.864 -1.147 . . . . 1.0 109.216 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -122.83 134.2 54.41 Favored 'General case' 0 N--CA 1.435 -1.213 0 N-CA-C 114.822 1.415 . . . . 1.0 114.822 -154.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -83.02 114.67 21.43 Favored 'General case' 0 N--CA 1.433 -1.275 0 C-N-CA 125.776 1.63 . . . . 1.0 111.605 177.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.3 t -103.9 -2.82 25.63 Favored 'General case' 0 CA--C 1.497 -1.089 0 O-C-N 120.553 -1.342 . . . . 1.0 114.083 -169.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.01 5.89 88.9 Favored Glycine 0 CA--C 1.494 -1.241 0 O-C-N 119.758 -1.839 . . . . 1.0 116.045 167.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.705 0 N-CA-C 109.227 -1.549 . . . . 1.0 109.227 179.726 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.827 0 N-CA-C 112.137 -0.385 . . . . 1.0 112.137 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.481 0.3 OUTLIER -97.06 -97.77 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 C-N-CA 124.291 1.036 . . . . 1.0 112.635 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.9 mt -88.82 116.61 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 O-C-N 119.857 -1.777 . . . . 1.0 113.259 -163.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -102.17 109.24 20.88 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 118.903 -2.373 . . . . 1.0 109.132 160.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . 0.412 HD12 ' HB ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -99.61 165.2 11.73 Favored 'General case' 0 CA--C 1.498 -1.053 0 O-C-N 119.651 -1.906 . . . . 1.0 114.389 -168.323 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 14.8 t -150.55 141.13 22.57 Favored 'General case' 0 CA--C 1.498 -1.04 0 O-C-N 120.198 -1.564 . . . . 1.0 113.23 170.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 23.6 ptm -153.72 25.49 0.51 Allowed 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 125.427 1.491 . . . . 1.0 110.973 165.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -145.37 7.07 1.13 Allowed 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.875 -1.141 . . . . 1.0 112.253 -162.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . 0.258 40.9 m-20 66.46 153.06 0.07 Allowed 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 123.024 1.392 . . . . 1.0 111.071 -144.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.37 -47.45 73.35 Favored 'General case' 0 N--CA 1.435 -1.218 0 O-C-N 119.484 -2.01 . . . . 1.0 114.717 -169.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.282 29.7 tt0 . . . . . 0 C--O 1.261 1.664 0 O-C-N 119.639 -1.913 . . . . 1.0 114.464 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.0 mtm . . . . . 0 N--CA 1.481 1.115 0 N-CA-C 111.855 0.317 . . . . 1.0 111.855 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.67 -46.47 72.28 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 129.438 3.095 . . . . 1.0 112.816 -16.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 58.97 43.57 17.64 Favored 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 126.739 2.016 . . . . 1.0 115.658 172.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -97.76 5.49 49.12 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.158 -1.589 . . . . 1.0 112.578 -168.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -64.71 152.47 90.04 Favored Pre-proline 0 N--CA 1.435 -1.202 0 C-N-CA 125.532 1.533 . . . . 1.0 115.057 -178.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -41.55 147.06 0.41 Allowed 'Trans proline' 0 N--CA 1.443 -1.498 1 C-N-CA 125.546 4.164 . . . . 1.0 119.159 168.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -120.2 126.06 49.71 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 124.192 0.997 . . . . 1.0 111.307 -173.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -99.65 -0.91 39.3 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 126.12 1.768 . . . . 1.0 112.651 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 94.62 34.69 6.19 Favored Glycine 0 N--CA 1.435 -1.381 0 O-C-N 120.338 -1.476 . . . . 1.0 114.577 174.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.9 t -77.3 116.91 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.137 0 O-C-N 121.296 -1.12 . . . . 1.0 109.367 171.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -120.58 -10.0 9.3 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.911 -1.118 . . . . 1.0 112.111 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.261 19.7 m 52.19 60.07 4.08 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 127.156 2.182 . . . . 1.0 113.146 176.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -98.3 106.06 18.29 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 120.91 -1.119 . . . . 1.0 110.579 -167.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -83.8 -33.54 24.93 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.774 -1.204 . . . . 1.0 112.285 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -62.94 150.24 42.64 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 115.926 1.824 . . . . 1.0 115.926 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.65 25.92 1.49 Allowed 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 126.982 2.113 . . . . 1.0 111.646 164.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -99.04 136.69 38.63 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.67 1.224 . . . . 1.0 109.271 172.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.7 pt -139.38 160.7 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 126.461 1.904 . . . . 1.0 107.282 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -117.7 144.73 44.98 Favored 'General case' 0 N--CA 1.432 -1.329 0 N-CA-C 106.092 -1.818 . . . . 1.0 106.092 170.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.7 156.06 45.56 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 105.256 -2.128 . . . . 1.0 105.256 168.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -115.72 150.61 36.55 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 125.786 1.635 . . . . 1.0 109.91 169.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -111.28 127.59 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.675 0 N-CA-C 105.719 -1.956 . . . . 1.0 105.719 171.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -130.3 130.15 44.14 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.163 0.982 . . . . 1.0 111.581 -174.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.0 -154.31 11.83 Favored Glycine 0 CA--C 1.492 -1.395 0 N-CA-C 108.548 -1.821 . . . . 1.0 108.548 172.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 54.32 54.55 9.3 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 116.385 1.994 . . . . 1.0 116.385 160.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 59.97 40.47 18.84 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 127.941 2.497 . . . . 1.0 113.951 -178.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.09 11.34 65.1 Favored Glycine 0 N--CA 1.436 -1.334 0 O-C-N 119.851 -1.781 . . . . 1.0 114.288 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.0 m -70.31 133.53 47.06 Favored 'General case' 0 CA--C 1.497 -1.086 0 O-C-N 121.292 -1.122 . . . . 1.0 112.021 170.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 p -139.94 139.89 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 C-N-CA 123.904 0.882 . . . . 1.0 112.273 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.258 0.4 OUTLIER -129.25 138.8 53.45 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.083 0 O-C-N 119.636 -1.915 . . . . 1.0 110.531 158.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.06 139.54 53.18 Favored 'General case' 0 CA--C 1.494 -1.202 0 CA-C-O 123.425 1.583 . . . . 1.0 113.479 175.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.472 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.1 OUTLIER -144.06 146.86 33.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.745 -1.222 . . . . 1.0 112.963 -165.339 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.269 20.5 ttpt -112.78 115.85 29.15 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.858 1.263 . . . . 1.0 113.371 -166.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.9 154.67 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 123.576 1.655 . . . . 1.0 110.878 -152.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -106.63 165.72 11.09 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 123.298 1.523 . . . . 1.0 114.217 -170.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -62.97 -38.17 90.04 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.193 2.294 . . . . 1.0 117.193 -159.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.28 15.88 21.58 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.536 -1.353 . . . . 1.0 113.764 -178.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 16.1 m -84.08 135.93 41.58 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 124.855 1.262 . . . . 1.0 111.723 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.13 152.6 76.19 Favored 'Trans proline' 0 N--CA 1.441 -1.571 0 C-N-CA 123.039 2.492 . . . . 1.0 114.576 173.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.332 3.4 pp -61.88 -25.69 67.7 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 114.405 1.261 . . . . 1.0 114.405 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 83.7 p -52.72 -29.06 24.81 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 119.538 -1.976 . . . . 1.0 116.067 166.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -74.55 -45.88 42.68 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 119.557 -1.965 . . . . 1.0 110.618 -167.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.451 ' H ' HD11 ' A' ' 43' ' ' LEU 0.327 0.0 OUTLIER -68.85 -31.13 69.86 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.695 1.368 . . . . 1.0 114.695 170.233 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 18.4 ttt -61.04 -41.72 97.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.397 -2.065 . . . . 1.0 114.065 173.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -41.52 98.65 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 120.876 -1.14 . . . . 1.0 112.418 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.61 -36.84 81.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.118 1.525 . . . . 1.0 115.118 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -58.94 -43.86 91.28 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 120.025 -1.672 . . . . 1.0 112.185 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.2 m -62.3 -42.36 99.3 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.009 1.324 . . . . 1.0 113.02 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -67.19 -51.52 52.51 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 113.464 0.913 . . . . 1.0 113.464 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.7 -40.68 72.72 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 115.067 1.506 . . . . 1.0 115.067 -174.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -111.13 9.82 21.94 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.915 -1.116 . . . . 1.0 112.513 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.34 Favored Glycine 0 CA--C 1.493 -1.303 0 N-CA-C 115.871 1.108 . . . . 1.0 115.871 164.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.3 mt -116.92 160.41 20.95 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.73 -0.865 . . . . 1.0 111.725 -169.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.0 m -102.23 134.5 45.41 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 121.073 -1.017 . . . . 1.0 109.071 175.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 tpp -61.4 -37.91 85.16 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 127.276 2.23 . . . . 1.0 114.08 -165.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -95.82 1.38 53.12 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.481 -0.781 . . . . 1.0 112.072 -176.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -102.15 -3.98 26.58 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.342 1.057 . . . . 1.0 111.694 177.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.9 pt -123.33 146.12 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 124.471 1.108 . . . . 1.0 108.991 168.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -138.26 148.78 45.07 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 120.65 -1.281 . . . . 1.0 107.682 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -103.32 147.54 26.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 122.757 1.265 . . . . 1.0 111.854 -176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -131.19 161.19 32.74 Favored 'General case' 0 N--CA 1.433 -1.317 0 C-N-CA 125.809 1.643 . . . . 1.0 108.135 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -138.57 124.12 19.58 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 107.615 -1.254 . . . . 1.0 107.615 165.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.4 t0 58.54 32.53 22.23 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.591 1.556 . . . . 1.0 114.859 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.42 8.47 87.53 Favored Glycine 0 N--CA 1.435 -1.382 0 O-C-N 119.953 -1.717 . . . . 1.0 116.104 -173.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -117.14 142.14 29.58 Favored Pre-proline 0 N--CA 1.434 -1.234 0 CA-C-N 119.028 1.414 . . . . 1.0 108.481 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -74.7 142.4 28.82 Favored 'Trans proline' 0 C--N 1.307 -1.617 0 CA-C-N 123.286 2.209 . . . . 1.0 112.271 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 pt -116.83 143.84 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 N-CA-C 106.571 -1.64 . . . . 1.0 106.571 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -89.52 154.69 19.81 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 119.592 -1.943 . . . . 1.0 109.815 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -61.06 -27.71 68.54 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 118.845 -2.409 . . . . 1.0 115.217 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 m -95.51 5.64 51.02 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 124.218 1.007 . . . . 1.0 111.758 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -74.56 174.89 8.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.256 -2.153 . . . . 1.0 110.36 165.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.9 p -150.41 163.29 24.73 Favored Pre-proline 0 CA--C 1.498 -1.028 0 O-C-N 119.375 -2.078 . . . . 1.0 112.556 -153.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -57.48 -33.86 97.07 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 123.857 3.038 . . . . 1.0 116.253 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.8 -44.75 69.42 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 122.499 1.143 . . . . 1.0 113.027 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.51 -43.96 79.61 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 124.839 1.255 . . . . 1.0 113.334 -178.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.3 tp -90.83 -8.42 49.62 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.901 -1.124 . . . . 1.0 112.58 -178.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 62.29 44.96 7.09 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 126.794 2.038 . . . . 1.0 114.532 -178.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.6 mtt -59.41 151.32 24.11 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 127.074 2.149 . . . . 1.0 112.868 171.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -120.58 177.76 4.94 Favored 'General case' 0 N--CA 1.432 -1.333 0 O-C-N 121.213 -0.93 . . . . 1.0 109.073 -170.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -56.74 -26.77 57.94 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 127.695 2.398 . . . . 1.0 115.426 -175.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -136.07 83.21 1.99 Allowed 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 123.872 0.869 . . . . 1.0 109.101 162.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.4 166.36 19.48 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 120.121 -1.612 . . . . 1.0 114.581 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 m -132.58 118.42 19.18 Favored 'General case' 0 CA--C 1.496 -1.13 0 C-N-CA 124.503 1.121 . . . . 1.0 110.925 173.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.7 mm -108.64 140.94 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 C-N-CA 129.502 3.121 . . . . 1.0 109.595 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -110.83 134.33 52.61 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 119.465 -2.022 . . . . 1.0 107.615 -164.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 t -110.95 126.71 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-O 121.643 0.735 . . . . 1.0 109.339 -173.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -116.43 143.08 46.02 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-O 122.201 1.0 . . . . 1.0 110.836 170.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -88.16 139.82 30.11 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.547 -1.346 . . . . 1.0 112.703 -175.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -136.09 167.43 21.26 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.385 1.074 . . . . 1.0 109.769 -174.066 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -131.26 120.8 23.72 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 120.99 -1.069 . . . . 1.0 110.501 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 12.0 t -160.79 157.73 27.31 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 105.344 -2.095 . . . . 1.0 105.344 168.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -112.15 -20.61 6.63 Favored Glycine 0 N--CA 1.437 -1.296 0 O-C-N 120.738 -1.226 . . . . 1.0 113.185 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.788 0 O-C-N 121.225 -1.162 . . . . 1.0 112.906 -179.625 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.865 0 N-CA-C 113.536 0.174 . . . . 1.0 113.536 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 12.4 t -75.0 -60.79 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.162 0 CA-C-O 124.023 1.868 . . . . 1.0 111.57 -177.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . 0.472 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 8.4 mt -113.13 124.81 70.14 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.27 0 C-N-CA 127.327 2.251 . . . . 1.0 111.13 -168.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -102.1 125.41 48.78 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 106.424 -1.695 . . . . 1.0 106.424 163.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.77 153.53 39.95 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 119.298 3.073 . . . . 1.0 119.298 -157.077 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 13.7 t -123.73 169.56 11.39 Favored 'General case' 0 N--CA 1.437 -1.083 0 N-CA-C 106.217 -1.772 . . . . 1.0 106.217 161.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 4.2 ttt 84.89 26.46 0.07 Allowed 'General case' 0 CA--C 1.498 -1.039 0 C-N-CA 127.844 2.458 . . . . 1.0 107.398 -154.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -158.98 149.44 19.64 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.495 1.518 . . . . 1.0 107.477 -163.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -147.38 28.24 0.99 Allowed 'General case' 0 N--CA 1.434 -1.256 0 CA-C-O 122.894 1.33 . . . . 1.0 110.524 165.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -94.74 3.09 55.46 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 124.327 1.051 . . . . 1.0 109.097 172.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.359 25.8 tt0 . . . . . 0 C--O 1.261 1.67 1 C-N-CA 132.504 4.322 . . . . 1.0 118.888 172.039 . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 112.598 0.592 . . . . 1.0 112.598 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.88 -43.94 91.29 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 114.846 1.424 . . . . 1.0 114.846 173.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 43.42 54.95 5.05 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 118.476 2.769 . . . . 1.0 118.476 169.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . 0.274 15.9 tp10 74.9 123.83 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 126.168 1.787 . . . . 1.0 113.954 -178.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.6 tttp -64.6 130.5 94.76 Favored Pre-proline 0 N--CA 1.435 -1.2 0 C-N-CA 125.902 1.681 . . . . 1.0 113.756 -170.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_exo -57.79 121.45 10.04 Favored 'Trans proline' 0 N--CA 1.441 -1.601 0 C-N-CA 123.534 2.823 . . . . 1.0 115.875 169.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -77.62 -36.25 51.86 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.929 1.292 . . . . 1.0 114.131 176.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -70.18 -39.19 75.4 Favored 'General case' 0 N--CA 1.434 -1.237 0 O-C-N 120.356 -1.465 . . . . 1.0 114.081 -176.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.22 -14.53 81.58 Favored Glycine 0 CA--C 1.494 -1.259 0 N-CA-C 117.043 1.577 . . . . 1.0 117.043 -170.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.74 142.73 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 C-N-CA 124.621 1.168 . . . . 1.0 110.613 -177.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -128.59 156.0 44.04 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.239 -1.538 . . . . 1.0 109.776 176.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.4 p -99.42 12.66 35.75 Favored 'General case' 0 N--CA 1.437 -1.081 0 C-N-CA 124.929 1.292 . . . . 1.0 113.242 -167.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -59.41 138.78 57.54 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 115.303 1.594 . . . . 1.0 115.303 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.76 -33.16 75.03 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 126.986 2.114 . . . . 1.0 112.505 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -104.99 66.5 0.76 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 124.736 1.214 . . . . 1.0 112.497 174.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -145.54 133.74 21.64 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 106.254 -1.758 . . . . 1.0 106.254 168.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -65.0 161.8 17.96 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 116.176 1.917 . . . . 1.0 116.176 -179.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 37.0 pt -138.86 160.74 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 126.145 1.778 . . . . 1.0 108.556 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -117.76 144.91 44.87 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 119.179 -2.201 . . . . 1.0 108.035 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -127.43 157.09 40.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 119.219 -2.175 . . . . 1.0 105.433 169.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -120.41 150.6 40.53 Favored 'General case' 0 N--CA 1.432 -1.369 0 O-C-N 119.498 -2.001 . . . . 1.0 111.482 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -118.44 122.1 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 N-CA-C 106.023 -1.843 . . . . 1.0 106.023 177.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.13 131.64 54.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.543 1.137 . . . . 1.0 111.631 -169.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -163.04 -137.9 2.29 Favored Glycine 0 N--CA 1.434 -1.45 0 N-CA-C 109.465 -1.454 . . . . 1.0 109.465 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 43.42 45.14 5.23 Favored 'General case' 0 N--CA 1.436 -1.129 0 C-N-CA 128.005 2.522 . . . . 1.0 117.759 162.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 64.28 30.28 13.49 Favored 'General case' 0 N--CA 1.436 -1.167 0 C-N-CA 126.774 2.03 . . . . 1.0 113.61 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.6 19.01 7.64 Favored Glycine 0 N--CA 1.436 -1.306 0 O-C-N 120.891 -1.13 . . . . 1.0 114.557 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.3 m -115.47 144.99 43.02 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-N 119.504 1.652 . . . . 1.0 111.993 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -139.83 144.77 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 C-N-CA 124.247 1.019 . . . . 1.0 111.563 -167.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.256 0.5 OUTLIER -129.14 138.68 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 O-C-N 120.355 -1.466 . . . . 1.0 110.88 168.35 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.01 144.98 46.23 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 124.911 2.291 . . . . 1.0 113.963 -175.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -132.96 140.66 47.92 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.806 -1.809 . . . . 1.0 107.338 -165.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -108.47 118.51 36.96 Favored 'General case' 0 N--CA 1.434 -1.258 0 C-N-CA 126.415 1.886 . . . . 1.0 111.78 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 9.2 tt -147.91 154.73 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.351 0 CA-C-O 124.954 2.311 . . . . 1.0 110.646 -148.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -117.27 160.29 21.33 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 112.511 -2.131 . . . . 1.0 111.84 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -62.15 -38.13 87.83 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 117.4 2.37 . . . . 1.0 117.4 -159.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -74.49 -25.14 59.19 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.346 -1.471 . . . . 1.0 114.36 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.7 m -62.69 127.76 90.79 Favored Pre-proline 0 N--CA 1.436 -1.134 0 C-N-CA 125.885 1.674 . . . . 1.0 114.5 -172.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -69.81 158.47 56.79 Favored 'Trans proline' 0 N--CA 1.441 -1.582 0 C-N-CA 122.895 2.397 . . . . 1.0 113.986 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.439 2.8 pp -59.34 -25.48 64.24 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 114.565 1.32 . . . . 1.0 114.565 177.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 t -52.71 -29.03 24.55 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 120.154 -1.592 . . . . 1.0 113.738 171.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -43.28 88.38 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 119.959 -1.713 . . . . 1.0 113.24 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.421 0.0 OUTLIER -70.31 -31.22 68.45 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 171.169 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.6 tpp -60.22 -45.92 91.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 O-C-N 120.466 -1.396 . . . . 1.0 113.132 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -43.88 98.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 120.909 -1.12 . . . . 1.0 112.552 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.22 79.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.07 1.137 . . . . 1.0 114.07 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -62.7 -44.16 96.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 120.395 -1.44 . . . . 1.0 111.781 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.0 m -62.93 -41.86 99.62 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.731 1.213 . . . . 1.0 114.095 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -68.19 -51.32 47.02 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.984 -1.697 . . . . 1.0 114.868 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.63 -43.17 63.6 Favored 'General case' 0 CA--C 1.496 -1.116 0 O-C-N 120.049 -1.657 . . . . 1.0 113.749 -173.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -112.46 6.97 18.89 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 123.84 0.856 . . . . 1.0 113.036 -170.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.63 3.04 89.86 Favored Glycine 0 N--CA 1.437 -1.247 0 N-CA-C 118.631 2.212 . . . . 1.0 118.631 162.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.18 166.46 23.21 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.746 1.758 . . . . 1.0 115.746 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.1 m -102.25 129.42 48.65 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.549 -1.344 . . . . 1.0 110.455 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -66.55 -21.24 66.16 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 115.681 1.734 . . . . 1.0 115.681 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ptt-85 -77.85 -17.88 56.89 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.75 -1.219 . . . . 1.0 113.462 176.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -94.79 -16.82 22.68 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.392 1.077 . . . . 1.0 112.353 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.5 pt -119.98 141.2 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.2 0 C-N-CA 124.647 1.179 . . . . 1.0 110.251 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 154.94 49.04 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 107.001 -1.481 . . . . 1.0 107.001 171.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -113.2 148.67 34.99 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 122.302 1.049 . . . . 1.0 110.98 -171.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 41.2 ptt180 -137.51 158.15 45.01 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.753 -1.217 . . . . 1.0 111.525 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -137.52 121.2 17.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.51 -0.922 . . . . 1.0 108.51 174.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t70 56.4 40.35 29.74 Favored 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 126.223 1.809 . . . . 1.0 112.99 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.52 3.43 86.48 Favored Glycine 0 N--CA 1.438 -1.205 0 O-C-N 120.095 -1.628 . . . . 1.0 116.273 -176.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -116.65 139.76 25.93 Favored Pre-proline 0 N--CA 1.435 -1.189 0 CA-C-N 119.548 1.674 . . . . 1.0 110.493 -172.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.65 142.64 32.74 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.78 2.32 . . . . 1.0 112.84 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 pt -117.82 147.07 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 C-N-CA 125.439 1.496 . . . . 1.0 108.849 -178.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -109.18 160.58 15.97 Favored 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 120.755 -1.216 . . . . 1.0 110.849 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -69.84 -14.28 62.67 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 119.157 -2.214 . . . . 1.0 114.969 -177.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 95.8 m -99.34 0.46 42.95 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 124.849 1.26 . . . . 1.0 111.714 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -76.75 168.95 19.19 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 118.275 -2.766 . . . . 1.0 109.87 161.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 p -152.77 163.62 22.94 Favored Pre-proline 0 CA--C 1.497 -1.09 0 O-C-N 119.69 -1.881 . . . . 1.0 111.035 -155.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -58.4 -32.87 97.19 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 123.516 2.811 . . . . 1.0 115.781 167.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.82 -45.96 55.66 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 122.123 0.963 . . . . 1.0 112.57 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -66.86 -40.66 87.95 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 125.676 1.591 . . . . 1.0 113.423 -176.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -88.24 -8.34 55.41 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 121.123 -0.986 . . . . 1.0 112.272 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 62.88 48.21 4.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 126.501 1.92 . . . . 1.0 113.65 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.4 mtt -61.19 154.2 23.99 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.727 2.011 . . . . 1.0 112.792 170.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -114.26 -178.4 3.36 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 -172.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.39 10.2 p-10 -55.05 -26.61 38.69 Favored 'General case' 0 N--CA 1.435 -1.225 0 N-CA-C 116.654 2.094 . . . . 1.0 116.654 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -141.27 73.04 1.4 Allowed 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 125.469 1.508 . . . . 1.0 110.27 174.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.19 164.9 24.54 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 116.077 1.881 . . . . 1.0 116.077 -174.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.1 m -131.77 115.39 15.91 Favored 'General case' 0 CA--C 1.495 -1.149 0 C-N-CA 124.439 1.096 . . . . 1.0 111.361 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.4 mm -117.9 140.68 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 C-N-CA 126.84 2.056 . . . . 1.0 108.745 -175.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.92 145.7 37.87 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.139 -1.601 . . . . 1.0 110.02 -166.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.6 t -108.56 135.21 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 124.297 1.039 . . . . 1.0 109.014 -177.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -121.83 136.35 54.93 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 122.678 1.228 . . . . 1.0 109.637 164.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -87.93 132.56 34.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 124.268 1.027 . . . . 1.0 110.413 -173.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 96.8 mm-40 -93.07 176.4 6.43 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 115.593 1.701 . . . . 1.0 115.593 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -112.65 11.48 19.58 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 125.623 1.569 . . . . 1.0 111.014 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 20.4 m -65.23 117.73 8.22 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.769 2.028 . . . . 1.0 114.45 -173.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.71 146.59 49.68 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 115.756 1.062 . . . . 1.0 115.756 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.736 0 O-C-N 121.713 -0.875 . . . . 1.0 111.035 179.868 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 CA-C-O 120.128 -0.262 . . . . 1.0 113.211 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -74.95 -47.22 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 CA-C-N 119.224 1.512 . . . . 1.0 113.964 171.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.7 mt -112.43 116.32 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-O 121.993 0.901 . . . . 1.0 109.715 -169.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.07 103.68 14.27 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 120.463 -1.398 . . . . 1.0 108.803 174.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -107.97 151.65 25.52 Favored 'General case' 0 CA--C 1.497 -1.071 0 O-C-N 119.731 -1.856 . . . . 1.0 115.077 -171.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 40.8 p -88.73 -106.66 0.08 Allowed 'General case' 0 N--CA 1.437 -1.108 0 O-C-N 120.498 -1.376 . . . . 1.0 112.312 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.259 0.3 OUTLIER 78.59 -45.98 0.4 Allowed 'General case' 0 CA--C 1.495 -1.164 0 C-N-CA 128.234 2.613 . . . . 1.0 116.49 173.729 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -153.91 163.76 39.52 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 106.392 -1.707 . . . . 1.0 106.392 -161.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . 0.545 ' CG ' ' H ' ' B' ' 974' ' ' GLU . 6.8 t70 50.69 -146.76 0.42 Allowed 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 123.533 1.635 . . . . 1.0 114.323 175.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . 0.545 ' H ' ' CG ' ' B' ' 973' ' ' ASP . 77.2 mt-10 -135.37 -25.95 1.29 Allowed 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 126.755 2.022 . . . . 1.0 110.53 -173.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.26 1.656 0 C-N-CA 126.785 2.034 . . . . 1.0 116.166 -176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.8 mtt . . . . . 0 N--CA 1.483 1.181 0 CA-C-O 121.127 0.489 . . . . 1.0 112.119 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.08 -42.99 96.77 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.079 1.352 . . . . 1.0 114.321 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -110.52 124.03 51.04 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 106.002 -1.851 . . . . 1.0 106.002 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.428 ' CD ' ' HZ3' ' A' ' 11' ' ' LYS . 27.0 tt0 -146.94 70.38 1.2 Allowed 'General case' 0 N--CA 1.436 -1.154 0 O-C-N 120.199 -1.563 . . . . 1.0 111.963 -170.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -64.72 143.82 98.76 Favored Pre-proline 0 N--CA 1.435 -1.19 0 O-C-N 120.515 -1.366 . . . . 1.0 114.288 171.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -55.85 136.46 74.69 Favored 'Trans proline' 0 N--CA 1.441 -1.559 0 C-N-CA 124.063 3.176 . . . . 1.0 117.308 168.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -158.51 174.87 14.43 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 118.982 0.81 . . . . 1.0 110.365 177.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -61.51 149.16 39.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 116.747 2.129 . . . . 1.0 116.747 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 60.08 -176.31 3.68 Favored Glycine 0 N--CA 1.438 -1.232 0 N-CA-C 117.727 1.851 . . . . 1.0 117.727 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.7 t -96.38 124.79 49.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.183 0 O-C-N 120.631 -1.511 . . . . 1.0 109.928 -172.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.428 ' HZ3' ' CD ' ' A' ' 4' ' ' GLU . 59.1 pttt -58.82 142.71 49.59 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 116.282 1.956 . . . . 1.0 116.282 -177.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 91.4 m -82.64 94.86 7.64 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 120.612 -1.305 . . . . 1.0 108.761 168.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -149.83 121.92 8.29 Favored 'General case' 0 N--CA 1.433 -1.282 0 C-N-CA 124.8 1.24 . . . . 1.0 108.247 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 53.89 48.01 22.23 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 126.664 1.985 . . . . 1.0 114.355 -176.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -121.07 156.34 32.45 Favored 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 124.473 1.109 . . . . 1.0 110.181 -174.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -98.48 -6.87 29.5 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.485 -1.384 . . . . 1.0 113.146 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -84.12 153.99 23.41 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.833 2.453 . . . . 1.0 112.64 165.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.8 pt -133.4 160.74 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.296 0 C-N-CA 129.47 3.108 . . . . 1.0 106.173 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.0 m-20 -113.12 144.81 42.01 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 118.885 -2.385 . . . . 1.0 108.185 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -128.37 155.91 43.95 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 105.967 -1.864 . . . . 1.0 105.967 171.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -123.87 150.6 44.42 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 120.495 -1.378 . . . . 1.0 111.968 172.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -118.93 119.25 60.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.178 0 N-CA-C 108.038 -1.097 . . . . 1.0 108.038 177.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.44 130.22 54.23 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 122.389 1.09 . . . . 1.0 113.268 -165.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.38 175.16 31.61 Favored Glycine 0 N--CA 1.433 -1.523 0 CA-C-O 122.882 1.268 . . . . 1.0 111.991 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -76.68 -13.6 60.03 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.388 1.255 . . . . 1.0 114.388 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -88.15 16.64 5.9 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.683 -1.26 . . . . 1.0 113.2 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.63 4.96 89.48 Favored Glycine 0 CA--C 1.493 -1.314 0 O-C-N 120.272 -1.518 . . . . 1.0 115.542 170.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.5 m -119.7 143.43 47.76 Favored 'General case' 0 CA--C 1.492 -1.283 0 CA-C-O 124.777 2.227 . . . . 1.0 111.727 170.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.6 p -139.95 147.07 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-N 110.56 -3.018 . . . . 1.0 106.715 -168.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -121.4 133.34 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 O-C-N 120.931 -1.105 . . . . 1.0 109.027 170.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.48 ' O ' ' HB ' ' B' ' 966' ' ' VAL . 0.0 OUTLIER -99.3 160.84 13.98 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.54 3.067 . . . . 1.0 114.583 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -145.1 140.54 28.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.297 -2.127 . . . . 1.0 105.526 -175.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -100.22 117.77 35.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 C-N-CA 127.317 2.247 . . . . 1.0 107.657 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.434 HG13 ' H ' ' A' ' 35' ' ' LYS . 12.3 tt -146.1 154.87 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.281 0 C-N-CA 127.937 2.495 . . . . 1.0 111.33 -151.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' H ' HG13 ' A' ' 34' ' ' ILE . 0.0 OUTLIER -122.73 167.54 13.34 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 113.595 -1.638 . . . . 1.0 113.705 -174.265 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -66.57 -38.21 86.59 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 116.989 2.218 . . . . 1.0 116.989 -162.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -87.11 -27.78 22.9 Favored 'General case' 0 CA--C 1.494 -1.175 0 O-C-N 120.2 -1.562 . . . . 1.0 111.226 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.6 m -57.75 111.99 4.19 Favored Pre-proline 0 N--CA 1.436 -1.13 0 C-N-CA 127.834 2.454 . . . . 1.0 113.686 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -67.47 163.19 35.75 Favored 'Trans proline' 0 N--CA 1.441 -1.607 0 C-N-CA 124.055 3.17 . . . . 1.0 116.081 -172.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.45 2.5 pp -64.74 -25.59 68.0 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.087 1.514 . . . . 1.0 115.087 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 97.3 p -52.68 -29.1 24.68 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.876 -1.765 . . . . 1.0 114.915 168.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.18 -43.92 80.96 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.214 -1.554 . . . . 1.0 112.094 -177.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.4 -35.59 77.88 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.555 -1.341 . . . . 1.0 113.568 171.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.3 ttm -60.59 -43.65 97.14 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.318 -1.488 . . . . 1.0 114.207 176.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -66.72 -39.44 88.02 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.517 -1.364 . . . . 1.0 112.971 174.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.91 82.66 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.249 -1.532 . . . . 1.0 114.392 177.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -58.54 -43.85 89.39 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 126.542 1.937 . . . . 1.0 110.863 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.9 m -62.01 -41.75 98.42 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 120.332 -1.48 . . . . 1.0 114.055 174.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -67.15 -47.71 70.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 114.707 1.373 . . . . 1.0 114.707 175.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -73.14 -43.25 61.89 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 115.892 1.812 . . . . 1.0 115.892 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -112.49 4.17 17.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 121.611 -0.68 . . . . 1.0 112.051 -164.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.49 24.37 47.03 Favored Glycine 0 CA--C 1.494 -1.272 0 N-CA-C 117.403 1.721 . . . . 1.0 117.403 159.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.3 mt -103.7 166.88 10.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 124.773 1.229 . . . . 1.0 112.733 -171.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.9 m -101.91 133.19 47.07 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 120.552 -1.342 . . . . 1.0 110.08 171.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 20.5 ptp -66.45 -25.42 66.72 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 115.499 1.666 . . . . 1.0 115.499 -170.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 -87.05 -1.62 58.01 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.281 -1.512 . . . . 1.0 112.783 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -102.82 -4.73 24.47 Favored 'General case' 0 N--CA 1.433 -1.297 0 O-C-N 120.893 -1.129 . . . . 1.0 111.792 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.6 pt -118.95 142.37 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 O-C-N 120.69 -1.256 . . . . 1.0 111.326 175.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -138.16 143.85 40.48 Favored 'General case' 0 N--CA 1.434 -1.268 0 O-C-N 120.246 -1.534 . . . . 1.0 107.542 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -105.65 145.16 31.39 Favored 'General case' 0 N--CA 1.433 -1.318 0 O-C-N 121.102 -0.999 . . . . 1.0 109.346 -175.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -120.84 152.61 38.18 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.462 1.125 . . . . 1.0 109.838 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -127.99 119.23 25.05 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.261 -1.755 . . . . 1.0 106.261 162.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.8 t70 52.68 45.99 27.59 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.075 1.35 . . . . 1.0 113.615 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.73 3.92 87.58 Favored Glycine 0 N--CA 1.435 -1.406 0 N-CA-C 117.823 1.889 . . . . 1.0 117.823 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -121.38 144.63 40.47 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 120.762 2.281 . . . . 1.0 109.039 176.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -68.04 149.65 77.17 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 122.785 2.03 . . . . 1.0 113.701 176.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.9 pt -116.84 141.97 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.258 0 N-CA-C 106.012 -1.847 . . . . 1.0 106.012 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -112.64 171.26 7.63 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 120.481 -1.387 . . . . 1.0 109.842 -162.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -73.53 -16.77 61.27 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.428 -2.045 . . . . 1.0 113.131 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.7 m -83.54 -13.88 53.51 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 125.15 1.38 . . . . 1.0 112.436 167.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -77.36 167.37 21.8 Favored 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.087 -2.258 . . . . 1.0 111.208 168.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.0 p -154.78 160.4 30.95 Favored Pre-proline 0 CA--C 1.496 -1.103 0 O-C-N 120.057 -1.652 . . . . 1.0 109.873 -160.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.1 -41.17 26.91 Favored 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 124.352 3.368 . . . . 1.0 116.328 161.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.09 88.1 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 114.489 1.292 . . . . 1.0 114.489 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -71.42 -38.4 71.4 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.323 1.449 . . . . 1.0 113.014 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 tp -94.57 -1.93 52.43 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 121.088 -1.008 . . . . 1.0 112.905 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 55.29 48.22 19.74 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 126.495 1.918 . . . . 1.0 114.915 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.6 mtt -62.2 144.12 55.89 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 126.136 1.774 . . . . 1.0 113.758 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -92.49 176.33 6.5 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 122.354 1.073 . . . . 1.0 112.473 -174.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.258 9.3 p-10 -56.57 -26.52 55.44 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 127.832 2.453 . . . . 1.0 115.144 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -138.39 75.36 1.52 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 125.185 1.394 . . . . 1.0 108.123 166.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.76 157.22 31.79 Favored 'General case' 0 N--CA 1.436 -1.145 0 O-C-N 119.668 -1.895 . . . . 1.0 113.696 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.9 m -125.62 115.25 19.84 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.905 0.86 . . . . 1.0 110.314 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.3 mm -122.02 140.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.172 0 C-N-CA 127.548 2.339 . . . . 1.0 108.747 -172.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -110.91 147.02 35.52 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.855 -1.778 . . . . 1.0 109.578 -163.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 59.8 t -108.53 129.33 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.22 0 O-C-N 121.002 -1.062 . . . . 1.0 109.865 -175.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -118.71 138.88 52.33 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 122.97 1.367 . . . . 1.0 110.701 163.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -87.19 142.37 27.96 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 121.15 -0.969 . . . . 1.0 112.764 -175.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -134.86 164.32 27.83 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.199 -0.938 . . . . 1.0 110.785 -169.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -131.98 160.49 35.68 Favored 'General case' 0 N--CA 1.435 -1.207 0 C-N-CA 124.539 1.135 . . . . 1.0 109.148 -174.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 41.2 p -136.94 -27.45 1.0 Allowed 'General case' 0 N--CA 1.437 -1.076 0 O-C-N 121.025 -1.047 . . . . 1.0 112.967 178.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.37 8.67 87.62 Favored Glycine 0 N--CA 1.436 -1.33 0 O-C-N 120.024 -1.673 . . . . 1.0 113.565 -169.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.701 0 N-CA-C 108.171 -1.972 . . . . 1.0 108.171 -179.047 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.917 0 N-CA-C 115.076 0.79 . . . . 1.0 115.076 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 31' ' ' GLN . 31.1 t -96.41 -100.33 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 C-N-CA 124.456 1.102 . . . . 1.0 113.199 -176.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 1.2 mt -94.41 123.94 46.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 O-C-N 121.053 -1.029 . . . . 1.0 108.501 -159.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -101.98 107.1 18.13 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.183 -1.573 . . . . 1.0 107.033 172.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.3 pp -108.02 153.17 23.49 Favored 'General case' 0 N--CA 1.437 -1.077 0 O-C-N 120.219 -1.55 . . . . 1.0 112.824 -172.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 6.4 m -132.57 131.48 41.55 Favored 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 107.266 -1.383 . . . . 1.0 107.266 -173.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 12.8 ttt -149.22 -68.13 0.21 Allowed 'General case' 0 CA--C 1.489 -1.402 0 O-C-N 120.914 -1.116 . . . . 1.0 111.534 177.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -123.27 -75.9 0.59 Allowed 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.522 -0.763 . . . . 1.0 109.548 -165.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.13 140.86 51.94 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 124.648 1.179 . . . . 1.0 112.302 -171.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.33 -43.79 79.38 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 116.308 1.966 . . . . 1.0 116.308 -166.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.252 32.5 tt0 . . . . . 0 N--CA 1.425 -1.702 0 C-N-CA 127.676 2.391 . . . . 1.0 114.022 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 113.622 0.971 . . . . 1.0 113.622 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.02 -45.77 73.08 Favored 'General case' 0 N--CA 1.434 -1.246 0 O-C-N 120.544 -1.348 . . . . 1.0 113.293 167.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -70.48 141.22 52.01 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 124.462 1.105 . . . . 1.0 112.751 174.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -87.79 -39.13 15.14 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.136 -1.603 . . . . 1.0 111.003 171.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -64.74 143.59 98.75 Favored Pre-proline 0 N--CA 1.435 -1.212 0 O-C-N 120.858 -1.151 . . . . 1.0 112.987 175.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -75.31 155.6 41.53 Favored 'Trans proline' 0 N--CA 1.44 -1.649 0 C-N-CA 122.572 2.181 . . . . 1.0 112.186 -175.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -66.16 149.83 49.69 Favored 'General case' 0 N--CA 1.435 -1.225 0 C-N-CA 124.313 1.045 . . . . 1.0 113.491 176.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -124.18 136.8 54.45 Favored 'General case' 0 N--CA 1.434 -1.275 0 C-N-CA 124.39 1.076 . . . . 1.0 110.516 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.27 1.35 90.41 Favored Glycine 0 CA--C 1.493 -1.333 0 O-C-N 120.552 -1.342 . . . . 1.0 114.743 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 66.8 t -68.43 -41.19 83.18 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 C-N-CA 125.087 1.355 . . . . 1.0 110.672 171.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -123.74 -43.04 2.15 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 122.417 1.104 . . . . 1.0 112.215 174.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 54.9 p -153.85 160.71 42.29 Favored 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 125.647 1.579 . . . . 1.0 110.845 -174.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.406 ' H ' ' CD ' ' A' ' 13' ' ' GLU . 0.8 OUTLIER -70.95 150.31 45.81 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 124.991 1.317 . . . . 1.0 113.234 166.319 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -107.76 162.39 14.03 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 124.972 1.309 . . . . 1.0 109.453 -177.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -134.65 115.81 14.23 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.39 -1.444 . . . . 1.0 108.519 178.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -158.92 162.98 36.93 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-O 124.527 2.108 . . . . 1.0 110.976 -177.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -126.71 163.51 23.34 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 129.788 3.235 . . . . 1.0 113.098 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.6 pt -136.37 160.63 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 C-N-CA 128.53 2.732 . . . . 1.0 106.343 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -117.66 144.7 44.96 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 119.641 -1.912 . . . . 1.0 106.589 169.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.47 154.55 51.35 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.392 -1.443 . . . . 1.0 107.142 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -120.0 148.23 43.81 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.071 1.748 . . . . 1.0 111.354 175.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 t -119.98 122.93 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 N-CA-C 107.783 -1.192 . . . . 1.0 107.783 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.57 130.17 55.01 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 124.615 1.166 . . . . 1.0 111.883 -172.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.56 -173.39 33.68 Favored Glycine 0 N--CA 1.437 -1.294 0 CA-C-O 122.746 1.192 . . . . 1.0 114.756 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -75.95 -16.02 60.07 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 120.747 -1.443 . . . . 1.0 114.704 -166.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.1 p30 -100.72 5.07 43.57 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 124.9 1.28 . . . . 1.0 112.352 175.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.05 5.14 87.92 Favored Glycine 0 N--CA 1.436 -1.319 0 C-N-CA 124.885 1.231 . . . . 1.0 115.648 -179.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 m -70.31 132.65 46.01 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 120.74 -1.447 . . . . 1.0 112.248 174.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.3 p -130.01 137.33 56.77 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.16 0 O-C-N 121.166 -0.959 . . . . 1.0 113.421 -170.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -129.26 138.73 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.862 -1.774 . . . . 1.0 110.169 169.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.69 145.88 47.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-O 124.06 1.885 . . . . 1.0 113.77 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.83 141.7 44.73 Favored 'General case' 0 N--CA 1.432 -1.353 0 O-C-N 119.81 -1.806 . . . . 1.0 109.254 -166.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.272 26.7 ttpt -107.05 115.89 30.97 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.552 1.941 . . . . 1.0 113.483 -176.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 6.8 tt -148.86 154.62 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.429 0 CA-C-O 123.994 1.854 . . . . 1.0 109.833 -158.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.305 3.7 mppt? -95.89 165.76 12.12 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.316 -1.765 . . . . 1.0 112.48 -172.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.4 mtm180 -63.49 -38.07 89.72 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 115.847 1.795 . . . . 1.0 115.847 -160.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -85.43 -23.97 27.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.549 -1.344 . . . . 1.0 112.742 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.8 m -59.12 131.79 87.29 Favored Pre-proline 0 N--CA 1.436 -1.148 0 C-N-CA 126.972 2.109 . . . . 1.0 115.062 -169.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.02 162.05 41.61 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 124.097 3.198 . . . . 1.0 115.236 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.384 2.7 pp -66.91 -25.69 66.5 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 124.663 1.185 . . . . 1.0 114.178 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.4 p -52.74 -29.17 25.63 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 120.342 -1.474 . . . . 1.0 114.839 170.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.73 -43.53 65.69 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.212 -1.555 . . . . 1.0 112.32 -172.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.359 0.0 OUTLIER -68.09 -31.13 70.53 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.61 -1.306 . . . . 1.0 114.167 168.624 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 9.7 ttt -61.64 -43.43 98.88 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.535 -1.353 . . . . 1.0 114.001 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -67.47 -36.41 81.1 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 120.41 -1.431 . . . . 1.0 113.554 170.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.51 -34.89 77.78 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 119.411 -2.056 . . . . 1.0 114.323 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.6 -43.06 99.56 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 126.296 1.839 . . . . 1.0 111.914 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 75.4 m -61.51 -43.85 98.13 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.614 -1.304 . . . . 1.0 113.834 171.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -62.35 -51.84 66.02 Favored 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 120.6 -1.313 . . . . 1.0 114.442 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.47 -43.33 27.39 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 115.132 1.53 . . . . 1.0 115.132 -176.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -108.77 4.22 23.43 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 121.206 -0.933 . . . . 1.0 111.448 -166.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.01 4.95 89.74 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 117.896 1.919 . . . . 1.0 117.896 161.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.7 mt -76.63 160.95 28.96 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.742 1.617 . . . . 1.0 113.833 -173.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 m -102.27 131.77 48.63 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 120.426 -1.421 . . . . 1.0 109.138 168.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.9 ptp -66.58 -18.54 65.42 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 116.427 2.01 . . . . 1.0 116.427 -173.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -85.61 -8.92 57.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 120.602 -1.312 . . . . 1.0 114.078 173.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -82.07 -33.25 29.96 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.634 -1.916 . . . . 1.0 112.453 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.6 pt -113.59 152.68 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 C-N-CA 125.279 1.431 . . . . 1.0 111.119 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -137.69 154.92 49.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 O-C-N 120.511 -1.368 . . . . 1.0 108.055 172.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 -111.3 148.56 32.66 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.662 1.22 . . . . 1.0 110.553 -173.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 53.3 mtm180 -130.26 159.28 37.36 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 122.165 0.983 . . . . 1.0 109.454 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -133.8 125.71 29.05 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 163.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 48.35 44.79 20.35 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 126.816 2.046 . . . . 1.0 114.416 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.98 6.83 86.32 Favored Glycine 0 N--CA 1.435 -1.424 0 O-C-N 120.146 -1.596 . . . . 1.0 116.785 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -119.94 148.28 46.27 Favored Pre-proline 0 N--CA 1.436 -1.13 0 CA-C-N 121.14 2.47 . . . . 1.0 109.288 175.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.11 149.72 52.73 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 122.588 2.192 . . . . 1.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.1 pt -120.57 140.41 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 N-CA-C 107.166 -1.42 . . . . 1.0 107.166 174.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.51 164.28 11.75 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.759 -1.213 . . . . 1.0 110.957 -168.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.9 -13.89 60.59 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 119.056 -2.277 . . . . 1.0 113.945 -176.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 m -96.7 1.45 51.01 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 124.6 1.16 . . . . 1.0 111.226 170.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -82.5 172.0 13.5 Favored 'General case' 0 N--CA 1.432 -1.325 0 O-C-N 119.098 -2.251 . . . . 1.0 110.211 171.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.5 p -147.98 162.19 32.02 Favored Pre-proline 0 CA--C 1.498 -1.053 0 O-C-N 119.684 -1.885 . . . . 1.0 112.384 -153.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -56.17 -33.62 90.95 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 123.587 2.858 . . . . 1.0 115.879 166.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.88 -45.96 69.63 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 119.573 1.078 . . . . 1.0 113.541 176.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.26 -38.64 71.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 125.638 1.575 . . . . 1.0 113.63 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -93.27 -8.47 42.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 121.014 -1.053 . . . . 1.0 111.669 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 63.87 43.22 5.51 Favored 'General case' 0 N--CA 1.435 -1.219 0 C-N-CA 126.878 2.071 . . . . 1.0 113.763 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.2 147.0 49.18 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.216 1.807 . . . . 1.0 111.825 175.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -120.41 176.33 5.54 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 108.712 -0.847 . . . . 1.0 108.712 -168.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.276 10.7 p-10 -54.79 -26.54 35.32 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.837 2.055 . . . . 1.0 115.272 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.07 77.19 1.69 Allowed 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.582 1.553 . . . . 1.0 110.073 166.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.69 160.91 22.29 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 119.656 -1.903 . . . . 1.0 114.823 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -133.59 115.57 14.85 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 124.808 1.243 . . . . 1.0 111.059 -178.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.6 mm -120.4 140.72 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.027 0 C-N-CA 127.817 2.447 . . . . 1.0 111.049 -171.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -110.86 137.41 48.55 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.92 -1.738 . . . . 1.0 109.907 -162.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.65 132.21 57.19 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.246 0 O-C-N 120.774 -1.204 . . . . 1.0 109.63 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -120.4 137.3 54.39 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-O 123.135 1.445 . . . . 1.0 110.223 159.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -96.85 120.4 37.11 Favored 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 120.671 -1.268 . . . . 1.0 110.357 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 -80.08 -45.05 18.94 Favored 'General case' 0 N--CA 1.434 -1.268 0 O-C-N 121.124 -0.985 . . . . 1.0 111.831 -174.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 71.02 113.53 0.05 Allowed 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 126.414 1.886 . . . . 1.0 115.529 171.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 37.2 p -121.17 147.68 45.26 Favored 'General case' 0 CA--C 1.494 -1.207 0 O-C-N 120.236 -1.54 . . . . 1.0 110.393 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.14 -14.32 81.92 Favored Glycine 0 N--CA 1.436 -1.308 0 O-C-N 120.745 -1.222 . . . . 1.0 113.156 175.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.764 0 C-N-CA 126.389 1.947 . . . . 1.0 108.92 169.807 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 N-CA-C 114.178 0.431 . . . . 1.0 114.178 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.295 0.2 OUTLIER -74.81 -50.02 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 N-CA-C 115.234 1.568 . . . . 1.0 115.234 -171.707 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 6.3 mt -113.12 115.42 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 124.113 0.965 . . . . 1.0 109.699 -171.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -102.15 101.98 12.37 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.715 1.606 . . . . 1.0 110.897 172.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -108.24 159.44 16.62 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 118.922 2.934 . . . . 1.0 118.922 -168.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 37.3 p -85.33 178.08 7.6 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 128.315 2.646 . . . . 1.0 113.002 170.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.309 21.6 ttt 101.45 123.56 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.142 0 C-N-CA 128.87 2.868 . . . . 1.0 112.504 168.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . 0.319 62.2 m-20 53.21 59.7 4.24 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 126.087 1.755 . . . . 1.0 112.392 -163.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -78.38 78.93 4.84 Favored 'General case' 0 N--CA 1.432 -1.369 0 C-N-CA 125.743 1.617 . . . . 1.0 114.409 -167.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -86.9 48.01 1.58 Allowed 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 125.754 1.622 . . . . 1.0 110.167 158.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 . . . . . 0 C--O 1.26 1.637 0 C-N-CA 128.946 2.898 . . . . 1.0 115.581 -172.929 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.6 mmt . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 113.502 0.927 . . . . 1.0 113.502 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.51 -20.67 60.6 Favored 'General case' 0 N--CA 1.434 -1.265 0 O-C-N 120.952 -1.092 . . . . 1.0 113.396 176.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -119.42 134.29 55.29 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 124.779 1.231 . . . . 1.0 109.915 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -64.27 146.79 53.77 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.352 1.461 . . . . 1.0 111.683 169.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -64.64 145.97 98.5 Favored Pre-proline 0 N--CA 1.436 -1.154 0 N-CA-C 115.272 1.582 . . . . 1.0 115.272 -170.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -59.15 161.7 15.65 Favored 'Trans proline' 0 N--CA 1.443 -1.489 0 C-N-CA 123.912 3.075 . . . . 1.0 117.737 -171.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -62.22 -43.99 97.58 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 114.389 1.255 . . . . 1.0 114.389 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -99.8 5.38 45.54 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.63 -1.294 . . . . 1.0 112.307 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 69.74 168.45 6.47 Favored Glycine 0 N--CA 1.436 -1.314 0 N-CA-C 117.335 1.694 . . . . 1.0 117.335 176.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.3 p -66.77 133.24 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 125.058 1.343 . . . . 1.0 114.415 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -110.67 20.31 17.77 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 125.309 1.444 . . . . 1.0 112.635 -171.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.4 p -59.55 151.04 25.36 Favored 'General case' 0 CA--C 1.496 -1.1 0 C-N-CA 126.542 1.937 . . . . 1.0 115.146 176.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -92.57 137.05 32.7 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.927 -1.108 . . . . 1.0 112.069 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -141.02 147.06 38.07 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 120.628 -1.295 . . . . 1.0 107.866 172.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -176.18 33.0 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 113.191 0.812 . . . . 1.0 113.191 -163.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -142.43 141.69 32.26 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 105.844 -1.91 . . . . 1.0 105.844 -178.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.4 p-80 -50.34 140.16 13.92 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 117.272 2.323 . . . . 1.0 117.272 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.2 pt -133.26 160.82 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.3 0 C-N-CA 128.732 2.813 . . . . 1.0 107.38 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -110.09 144.92 37.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 O-C-N 118.988 -2.32 . . . . 1.0 108.441 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.4 HD21 HG23 ' A' ' 34' ' ' ILE . 1.5 pt? -127.13 149.79 49.79 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.678 -1.889 . . . . 1.0 106.384 169.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -117.71 148.83 41.64 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 119.74 -1.85 . . . . 1.0 110.629 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.4 t -117.3 127.95 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.271 0 N-CA-C 107.127 -1.434 . . . . 1.0 107.127 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.69 130.13 55.67 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.2 1.0 . . . . 1.0 110.323 176.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.12 -177.2 51.85 Favored Glycine 0 N--CA 1.435 -1.427 0 CA-C-O 123.093 1.385 . . . . 1.0 114.096 178.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -64.96 -31.92 73.4 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 125.159 1.384 . . . . 1.0 113.042 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -91.32 7.12 42.48 Favored 'General case' 0 N--CA 1.432 -1.337 0 C-N-CA 125.851 1.66 . . . . 1.0 112.858 -173.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.65 7.38 87.49 Favored Glycine 0 N--CA 1.436 -1.329 0 O-C-N 120.805 -1.184 . . . . 1.0 115.125 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.4 m -85.31 133.39 34.15 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 121.342 -1.093 . . . . 1.0 110.075 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.4 p -139.86 130.78 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.108 0 C-N-CA 124.158 0.983 . . . . 1.0 112.611 -166.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.24 138.82 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.947 -1.72 . . . . 1.0 112.174 173.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.45 147.95 34.16 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-O 125.052 2.358 . . . . 1.0 115.488 175.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -132.95 140.62 47.91 Favored 'General case' 0 N--CA 1.432 -1.365 0 O-C-N 119.523 -1.985 . . . . 1.0 107.862 -170.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -104.56 118.96 37.88 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 126.318 1.847 . . . . 1.0 109.368 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.4 HG23 HD21 ' A' ' 20' ' ' LEU . 12.8 tt -148.46 154.81 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.317 0 CA-C-O 125.238 2.447 . . . . 1.0 111.537 -151.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -104.97 160.35 15.1 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 112.844 -1.98 . . . . 1.0 112.201 -176.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -61.74 -38.08 86.64 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 116.198 1.925 . . . . 1.0 116.198 -166.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -98.52 -9.8 24.45 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 119.982 -1.698 . . . . 1.0 113.654 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 88.9 m -62.05 121.68 67.29 Favored Pre-proline 0 N--CA 1.437 -1.101 0 C-N-CA 125.047 1.339 . . . . 1.0 111.402 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.59 160.23 44.53 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 CA-C-N 123.926 2.438 . . . . 1.0 114.309 -168.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.466 1.5 pp -61.45 -25.59 67.32 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 114.914 1.45 . . . . 1.0 114.914 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 99.0 p -52.77 -29.02 24.98 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.206 -1.559 . . . . 1.0 115.165 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.59 -46.98 67.91 Favored 'General case' 0 N--CA 1.437 -1.098 0 O-C-N 120.974 -1.079 . . . . 1.0 111.924 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.64 -31.5 70.69 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.667 -1.271 . . . . 1.0 112.914 174.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.6 ttp -59.82 -44.99 93.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.316 -1.49 . . . . 1.0 114.369 175.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -66.33 -38.44 87.68 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.778 -1.201 . . . . 1.0 112.697 174.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.96 -37.96 89.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 114.263 1.209 . . . . 1.0 114.263 174.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.01 -43.27 99.14 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 126.066 1.747 . . . . 1.0 111.902 174.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.3 m -62.17 -44.71 96.0 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.882 -1.136 . . . . 1.0 113.454 174.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -66.3 -49.52 66.78 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 114.17 1.174 . . . . 1.0 114.17 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -71.14 -43.29 67.87 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.04 -1.662 . . . . 1.0 115.285 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -115.32 6.35 14.88 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 121.077 -1.015 . . . . 1.0 112.929 -163.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.02 9.26 84.56 Favored Glycine 0 CA--C 1.493 -1.308 0 N-CA-C 117.153 1.621 . . . . 1.0 117.153 162.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.89 159.63 23.62 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.553 -1.557 . . . . 1.0 112.32 -175.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.3 m -102.33 134.02 46.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 O-C-N 121.1 -1.0 . . . . 1.0 110.146 172.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.7 ptp -66.26 -30.75 71.24 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 115.935 1.828 . . . . 1.0 115.935 -167.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt-85 -78.38 -15.04 59.1 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.348 -1.47 . . . . 1.0 113.455 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -92.07 -12.66 32.48 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.399 1.08 . . . . 1.0 111.756 -174.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -119.71 143.68 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.201 0 C-N-CA 124.34 1.056 . . . . 1.0 109.16 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -137.81 154.94 49.49 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.642 -1.286 . . . . 1.0 108.118 172.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -114.22 140.43 48.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 107.991 -1.115 . . . . 1.0 107.991 -162.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -129.67 149.54 51.38 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 120.822 -1.174 . . . . 1.0 109.191 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -123.53 112.31 17.32 Favored 'General case' 0 N--CA 1.433 -1.301 0 N-CA-C 107.81 -1.182 . . . . 1.0 107.81 160.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.6 t0 56.67 45.15 22.52 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 125.557 1.543 . . . . 1.0 113.974 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.94 1.44 84.88 Favored Glycine 0 N--CA 1.436 -1.309 0 N-CA-C 116.267 1.267 . . . . 1.0 116.267 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.61 125.81 31.87 Favored Pre-proline 0 N--CA 1.435 -1.223 0 CA-C-N 119.243 1.521 . . . . 1.0 108.994 -174.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -54.54 135.28 65.83 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.641 2.894 . . . . 1.0 115.79 169.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.8 pt -119.57 143.01 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -112.25 166.61 11.12 Favored 'General case' 0 CA--C 1.494 -1.2 0 O-C-N 120.407 -1.433 . . . . 1.0 110.995 -164.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -65.74 -21.49 66.52 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 119.825 -1.797 . . . . 1.0 114.755 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.1 m -82.89 -15.57 50.92 Favored 'General case' 0 N--CA 1.437 -1.109 0 C-N-CA 125.147 1.379 . . . . 1.0 112.959 171.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.8 168.75 19.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.217 -2.177 . . . . 1.0 112.637 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.1 p -148.63 158.81 39.65 Favored Pre-proline 0 CA--C 1.497 -1.08 0 O-C-N 120.179 -1.575 . . . . 1.0 110.68 -157.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -59.72 -30.91 93.25 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.18 2.586 . . . . 1.0 115.523 171.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.53 -46.03 74.01 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-O 122.035 0.921 . . . . 1.0 113.434 174.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -71.11 -42.56 69.13 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.717 1.207 . . . . 1.0 113.906 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.54 -8.54 58.88 Favored 'General case' 0 N--CA 1.435 -1.21 0 O-C-N 121.19 -0.944 . . . . 1.0 111.233 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 63.21 48.24 3.76 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 126.584 1.954 . . . . 1.0 112.983 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -64.67 148.55 50.77 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 127.201 2.201 . . . . 1.0 112.997 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -101.52 176.89 5.08 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 124.423 1.089 . . . . 1.0 110.069 -173.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.417 14.0 p-10 -60.48 -26.64 66.95 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 116.689 2.107 . . . . 1.0 116.689 -175.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -135.16 90.94 2.68 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.918 1.287 . . . . 1.0 108.442 157.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.51 163.57 22.59 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.845 -1.159 . . . . 1.0 114.013 -174.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.1 m -130.75 115.24 16.38 Favored 'General case' 0 CA--C 1.496 -1.098 0 O-C-N 121.307 -0.871 . . . . 1.0 110.337 177.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 47.1 mm -120.12 140.72 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 128.395 2.678 . . . . 1.0 109.452 -171.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -110.86 138.32 47.41 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 119.987 -1.696 . . . . 1.0 108.547 -164.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -115.56 133.53 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-O 122.789 1.28 . . . . 1.0 110.169 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -116.18 138.72 51.03 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 125.057 1.343 . . . . 1.0 110.218 169.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -89.11 137.21 32.53 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.884 -1.135 . . . . 1.0 111.874 -173.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -107.66 -155.94 0.57 Allowed 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.499 1.52 . . . . 1.0 110.5 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -62.94 111.19 2.04 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 125.609 1.563 . . . . 1.0 115.122 -176.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 81.2 p -94.58 -9.63 34.56 Favored 'General case' 0 CA--C 1.496 -1.117 0 O-C-N 120.08 -1.638 . . . . 1.0 112.313 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.8 -0.44 84.89 Favored Glycine 0 N--CA 1.436 -1.366 0 O-C-N 120.542 -1.349 . . . . 1.0 115.891 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.753 0 C-N-CA 124.736 1.16 . . . . 1.0 111.283 -178.417 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.869 0 CA-C-O 119.853 -0.415 . . . . 1.0 113.009 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.277 0.2 OUTLIER -74.81 -49.1 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.18 0 CA-C-N 120.032 1.916 . . . . 1.0 114.504 -176.214 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.2 mt -112.5 118.59 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 N-CA-C 108.39 -0.967 . . . . 1.0 108.39 -173.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -102.14 108.35 19.72 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 119.982 -1.698 . . . . 1.0 108.857 166.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.3 pp -107.95 156.32 19.34 Favored 'General case' 0 N--CA 1.437 -1.101 0 O-C-N 119.766 -1.834 . . . . 1.0 113.471 -170.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . 0.304 7.4 t -92.9 -145.12 0.22 Allowed 'General case' 0 N--CA 1.438 -1.036 0 C-N-CA 124.799 1.24 . . . . 1.0 112.175 178.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.256 23.8 ttt 80.32 103.78 0.07 Allowed 'General case' 0 N--CA 1.437 -1.088 0 C-N-CA 128.362 2.665 . . . . 1.0 115.504 175.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 49.42 -170.07 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.215 0 C-N-CA 130.004 3.321 . . . . 1.0 116.312 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 5.2 t0 75.29 159.73 0.22 Allowed 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 116.952 2.205 . . . . 1.0 116.952 146.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -80.74 115.33 20.18 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.882 -1.136 . . . . 1.0 113.044 -177.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.255 40.8 tt0 . . . . . 0 N--CA 1.426 -1.646 0 C-N-CA 125.51 1.524 . . . . 1.0 114.288 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.5 mmm . . . . . 0 N--CA 1.483 1.197 0 CA-C-O 118.87 -0.586 . . . . 1.0 111.886 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.81 -40.91 97.76 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 121.15 1.795 . . . . 1.0 115.454 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -88.77 144.36 26.29 Favored 'General case' 0 N--CA 1.435 -1.225 0 C-N-CA 123.838 0.855 . . . . 1.0 110.497 168.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -158.55 155.47 28.42 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.999 -1.063 . . . . 1.0 110.428 174.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -64.74 141.12 98.23 Favored Pre-proline 0 N--CA 1.435 -1.214 0 N-CA-C 115.25 1.574 . . . . 1.0 115.25 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -45.77 158.27 0.28 Allowed 'Trans proline' 0 N--CA 1.442 -1.521 1 C-N-CA 125.377 4.051 . . . . 1.0 118.991 164.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -116.5 9.9 14.4 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.426 1.09 . . . . 1.0 113.409 -164.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -60.21 142.65 54.14 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 115.778 1.77 . . . . 1.0 115.778 -174.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -71.77 133.16 20.72 Favored Glycine 0 N--CA 1.437 -1.266 0 O-C-N 120.753 -1.217 . . . . 1.0 115.174 175.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.1 m -121.95 -2.92 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.144 0 C-N-CA 124.513 1.125 . . . . 1.0 112.42 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -104.04 62.1 0.74 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.886 -1.759 . . . . 1.0 109.352 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 35.9 p -99.58 -10.57 21.89 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 125.216 1.406 . . . . 1.0 113.607 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 48.59 50.56 16.87 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 117.676 2.473 . . . . 1.0 117.676 166.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -101.07 -7.88 22.82 Favored 'General case' 0 N--CA 1.436 -1.149 0 O-C-N 119.625 -1.922 . . . . 1.0 115.01 -170.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -121.57 141.69 50.84 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.992 -1.068 . . . . 1.0 109.984 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . 0.276 40.8 m-20 -70.66 -40.61 72.92 Favored 'General case' 0 CA--C 1.49 -1.351 0 CA-C-O 124.839 2.257 . . . . 1.0 114.927 -178.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 -65.2 124.32 21.84 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 110.117 -3.22 . . . . 1.0 115.464 168.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.5 pt -143.02 160.83 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 C-N-CA 130.917 3.687 . . . . 1.0 105.991 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -113.74 144.81 42.34 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 118.21 -2.806 . . . . 1.0 107.55 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.417 HD21 ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -133.8 156.6 47.73 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 119.327 -2.108 . . . . 1.0 105.975 173.801 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.38 150.64 50.65 Favored 'General case' 0 N--CA 1.434 -1.26 0 O-C-N 119.809 -1.807 . . . . 1.0 112.524 171.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.1 t -113.02 129.15 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.921 -1.511 . . . . 1.0 106.921 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 136.37 54.88 Favored 'General case' 0 N--CA 1.433 -1.324 0 C-N-CA 124.504 1.122 . . . . 1.0 112.453 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 143.91 -143.37 12.15 Favored Glycine 0 CA--C 1.494 -1.277 0 O-C-N 121.06 -1.025 . . . . 1.0 114.719 170.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.8 tm0? 76.2 -65.72 0.3 Allowed 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 127.247 2.219 . . . . 1.0 114.752 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -153.57 22.86 0.53 Allowed 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 125.849 1.66 . . . . 1.0 108.555 -175.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.26 24.93 27.71 Favored Glycine 0 CA--C 1.493 -1.3 0 O-C-N 120.927 -1.108 . . . . 1.0 113.939 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.9 t -104.28 128.02 51.99 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 121.206 -1.173 . . . . 1.0 110.141 -175.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t -125.89 126.81 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 N-CA-C 107.421 -1.326 . . . . 1.0 107.421 175.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.1 p -129.16 138.02 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.101 0 O-C-N 121.325 -0.86 . . . . 1.0 111.204 174.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.486 ' O ' ' HB ' ' B' ' 966' ' ' VAL . 0.0 OUTLIER -100.98 160.07 14.68 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.829 3.204 . . . . 1.0 115.821 171.817 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -141.92 140.65 32.86 Favored 'General case' 0 N--CA 1.427 -1.61 0 O-C-N 118.954 -2.341 . . . . 1.0 105.174 -175.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.3 ttpt -101.39 117.32 34.7 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.336 -1.477 . . . . 1.0 107.618 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 6.4 tt -138.54 154.83 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-O 123.903 1.811 . . . . 1.0 110.09 -151.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -121.91 159.33 27.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.595 -1.639 . . . . 1.0 111.417 -177.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -71.23 -18.68 62.44 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 117.21 2.3 . . . . 1.0 117.21 -164.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 50.0 m80 -81.75 -28.64 33.22 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.925 -1.734 . . . . 1.0 112.481 167.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.4 m -66.88 116.16 32.45 Favored Pre-proline 0 N--CA 1.437 -1.088 0 N-CA-C 114.654 1.353 . . . . 1.0 114.654 -166.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.42 161.78 44.51 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 123.477 2.785 . . . . 1.0 115.099 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.454 3.0 pp -64.9 -25.63 67.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 114.582 1.327 . . . . 1.0 114.582 -178.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.5 p -52.85 -29.26 27.01 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 115.326 1.602 . . . . 1.0 115.326 167.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.19 -46.82 54.69 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.246 -1.534 . . . . 1.0 111.785 -171.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.507 ' H ' HD11 ' A' ' 43' ' ' LEU 0.337 0.0 OUTLIER -70.18 -31.29 68.69 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 113.995 1.109 . . . . 1.0 113.995 174.21 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.7 ttm -59.74 -45.85 90.95 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.413 -1.429 . . . . 1.0 113.797 170.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -65.15 -38.22 89.91 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.426 -1.421 . . . . 1.0 113.669 171.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.82 82.03 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 119.994 -1.691 . . . . 1.0 114.219 176.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.59 -41.13 94.08 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.695 1.998 . . . . 1.0 110.677 171.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 67.3 m -64.11 -43.51 95.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 120.66 -1.275 . . . . 1.0 113.812 172.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.93 -51.0 62.43 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.384 -1.448 . . . . 1.0 114.295 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -72.63 -43.21 63.53 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.365 -1.459 . . . . 1.0 114.77 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -116.26 12.26 15.34 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 121.799 0.809 . . . . 1.0 112.185 -162.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.38 10.8 85.59 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.411 1.325 . . . . 1.0 116.411 160.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.0 mt -80.48 159.95 25.41 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 124.887 1.275 . . . . 1.0 113.321 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 74.6 m -102.27 130.6 49.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.977 -1.077 . . . . 1.0 110.812 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.7 tpt -59.89 -38.27 81.76 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 116.298 1.962 . . . . 1.0 116.298 -165.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -94.71 1.68 55.51 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 120.705 -1.247 . . . . 1.0 111.993 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 -102.17 -8.37 21.4 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 121.086 -1.008 . . . . 1.0 111.126 175.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 pt -116.83 138.12 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.215 0 O-C-N 120.483 -1.386 . . . . 1.0 109.34 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -138.18 154.96 49.12 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 106.675 -1.602 . . . . 1.0 106.675 173.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -115.88 148.74 39.65 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.994 1.378 . . . . 1.0 111.077 -169.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.8 ptt180 -136.31 150.16 48.76 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 121.083 -1.011 . . . . 1.0 109.57 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -124.74 109.05 12.63 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.166 -1.79 . . . . 1.0 106.166 173.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . 0.435 38.3 m-20 59.67 -127.04 1.18 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-O 116.721 -1.609 . . . . 1.0 110.826 -144.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.25 -16.2 53.35 Favored Glycine 0 CA--C 1.495 -1.158 3 C-N-CA 138.983 7.944 . . . . 1.0 118.565 7.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -123.6 129.47 24.84 Favored Pre-proline 0 N--CA 1.435 -1.19 0 CA-C-N 120.11 1.955 . . . . 1.0 109.142 160.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.26 135.19 66.56 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.703 2.269 . . . . 1.0 113.048 156.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.6 pt -117.64 138.68 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.16 0 CA-C-O 122.142 0.972 . . . . 1.0 108.481 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -112.72 165.99 11.77 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 121.188 -0.945 . . . . 1.0 109.841 -162.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -71.7 -13.83 61.85 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.745 -1.847 . . . . 1.0 113.719 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.5 m -90.23 -7.42 53.56 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 126.295 1.838 . . . . 1.0 111.728 169.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -82.38 165.07 20.61 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 118.387 -2.695 . . . . 1.0 110.661 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.7 p -151.22 164.38 20.44 Favored Pre-proline 0 CA--C 1.498 -1.022 0 O-C-N 120.523 -1.361 . . . . 1.0 110.656 -154.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -60.3 -36.0 89.35 Favored 'Trans proline' 0 N--CA 1.441 -1.599 0 C-N-CA 123.044 2.496 . . . . 1.0 113.999 171.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.18 80.58 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-O 122.57 1.176 . . . . 1.0 112.574 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -68.77 -45.18 72.04 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.453 1.101 . . . . 1.0 113.376 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.8 tp -89.48 -8.4 52.96 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 121.061 -1.024 . . . . 1.0 112.781 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.26 33.0 mt-10 64.35 44.06 4.42 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 127.802 2.441 . . . . 1.0 115.663 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.7 mtt -57.11 154.24 10.31 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 129.17 2.988 . . . . 1.0 113.771 173.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -142.19 -176.23 4.74 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 106.793 -1.558 . . . . 1.0 106.793 -172.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.312 0.9 OUTLIER -53.16 -26.54 17.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.084 2.954 . . . . 1.0 118.628 -165.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -140.36 56.36 1.6 Allowed 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 124.784 1.234 . . . . 1.0 110.528 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.45 162.31 25.81 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 119.608 -1.933 . . . . 1.0 116.057 -174.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.2 m -131.72 118.98 20.7 Favored 'General case' 0 CA--C 1.497 -1.088 0 O-C-N 120.968 -1.082 . . . . 1.0 111.795 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.3 mt -119.27 140.7 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 C-N-CA 126.495 1.918 . . . . 1.0 108.995 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.95 137.38 48.65 Favored 'General case' 0 N--CA 1.434 -1.253 0 O-C-N 120.289 -1.507 . . . . 1.0 108.026 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.1 p -108.58 136.75 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.146 0 O-C-N 120.509 -1.369 . . . . 1.0 109.946 -177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -122.44 143.55 49.61 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.647 -1.283 . . . . 1.0 108.374 171.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -86.96 135.1 33.41 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.129 0.966 . . . . 1.0 112.15 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 -129.75 168.93 15.78 Favored 'General case' 0 N--CA 1.432 -1.333 0 C-N-CA 125.397 1.479 . . . . 1.0 109.675 -178.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 49.99 47.43 23.32 Favored 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 117.63 2.455 . . . . 1.0 117.63 169.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.1 m -83.94 124.02 30.57 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.359 -1.463 . . . . 1.0 109.708 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 82.18 12.86 80.18 Favored Glycine 0 N--CA 1.437 -1.269 0 O-C-N 120.405 -1.434 . . . . 1.0 114.982 -177.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.801 0 CA-C-N 118.042 0.921 . . . . 1.0 111.477 178.223 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.001 0 N-CA-C 114.181 0.433 . . . . 1.0 114.181 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . 0.486 ' HB ' ' O ' ' A' ' 31' ' ' GLN . 9.5 t -90.78 -110.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 120.808 -1.407 . . . . 1.0 112.468 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . 0.403 ' H ' ' HB ' ' B' ' 966' ' ' VAL . 0.9 OUTLIER -86.51 130.39 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 O-C-N 120.433 -1.417 . . . . 1.0 110.437 -155.263 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -102.17 112.34 24.97 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.918 -1.739 . . . . 1.0 109.981 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 56.2 mt -83.18 140.65 32.45 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 119.011 -2.306 . . . . 1.0 116.108 -174.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 77.2 p -95.07 -126.86 0.12 Allowed 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 124.906 1.282 . . . . 1.0 109.715 167.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 21.8 ttt 78.76 -40.29 0.26 Allowed 'General case' 0 N--CA 1.437 -1.095 0 C-N-CA 127.835 2.454 . . . . 1.0 115.508 171.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -154.21 177.13 11.45 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.767 1.627 . . . . 1.0 106.693 173.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -142.63 32.5 1.45 Allowed 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 120.361 -1.462 . . . . 1.0 113.993 -176.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -81.26 91.42 6.2 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.829 -1.17 . . . . 1.0 108.671 167.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 . . . . . 0 C--O 1.262 1.747 0 C-N-CA 127.798 2.439 . . . . 1.0 115.738 -172.098 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.2 mmm . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 110.682 -0.118 . . . . 1.0 110.682 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.4 -11.81 45.06 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.71 -1.868 . . . . 1.0 111.756 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -66.68 -25.43 66.55 Favored 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 126.892 2.077 . . . . 1.0 114.954 -178.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -95.83 1.91 53.43 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 124.845 1.258 . . . . 1.0 113.057 -176.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -74.09 150.8 88.03 Favored Pre-proline 0 N--CA 1.435 -1.217 0 C-N-CA 125.104 1.362 . . . . 1.0 111.763 170.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.22 140.7 31.21 Favored 'Trans proline' 0 N--CA 1.44 -1.627 0 C-N-CA 122.314 2.009 . . . . 1.0 112.655 178.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -72.56 149.34 44.11 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 122.717 1.246 . . . . 1.0 113.642 174.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.408 ' CD ' ' HD1' ' A' ' 17' ' ' HIS . 17.7 mt-10 -61.52 -40.41 94.52 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 125.516 1.526 . . . . 1.0 113.382 -178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -49.87 -51.71 28.25 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 125.114 1.34 . . . . 1.0 116.391 168.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.7 t -69.34 -47.15 74.86 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.111 0 O-C-N 121.043 -1.269 . . . . 1.0 112.837 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -65.45 -35.6 81.4 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 126.192 1.797 . . . . 1.0 114.002 -176.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.258 11.3 m 69.03 45.57 0.9 Allowed 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.542 2.337 . . . . 1.0 111.563 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -154.41 152.42 30.15 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.614 -1.304 . . . . 1.0 107.691 177.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -90.22 135.07 33.89 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 121.016 -1.053 . . . . 1.0 111.707 -171.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -127.43 -75.85 0.57 Allowed 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.998 -1.064 . . . . 1.0 109.592 -179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -101.87 -0.3 34.29 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 122.437 1.113 . . . . 1.0 112.993 -168.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.408 ' HD1' ' CD ' ' A' ' 8' ' ' GLU . 68.1 m80 -89.66 144.98 25.56 Favored 'General case' 0 N--CA 1.433 -1.298 0 C-N-CA 127.907 2.483 . . . . 1.0 110.844 162.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.3 pt -143.02 160.84 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 130.488 3.515 . . . . 1.0 104.961 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -109.58 144.79 37.4 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 119.102 -2.249 . . . . 1.0 108.431 166.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -128.2 154.29 45.98 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.425 -2.047 . . . . 1.0 105.792 170.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.07 150.68 44.7 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.701 -1.874 . . . . 1.0 111.756 169.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -110.9 136.78 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 O-C-N 121.166 -0.959 . . . . 1.0 108.64 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.17 130.15 53.58 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 124.494 1.118 . . . . 1.0 111.945 -174.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.71 -179.53 20.42 Favored Glycine 0 N--CA 1.435 -1.381 0 CA-C-O 122.915 1.286 . . . . 1.0 113.999 -177.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -99.15 3.66 46.61 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 125.238 1.415 . . . . 1.0 111.868 -169.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -98.95 2.1 46.14 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 125.903 1.681 . . . . 1.0 110.112 167.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.7 9.09 85.12 Favored Glycine 0 N--CA 1.435 -1.38 0 O-C-N 120.553 -1.342 . . . . 1.0 113.429 -173.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.4 p -70.15 145.22 51.68 Favored 'General case' 0 CA--C 1.494 -1.181 0 O-C-N 120.572 -1.546 . . . . 1.0 112.031 175.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p -139.79 127.05 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.239 0 N-CA-C 109.077 -0.712 . . . . 1.0 109.077 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.311 0.3 OUTLIER -129.36 135.86 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.105 0 O-C-N 119.692 -1.88 . . . . 1.0 111.164 166.15 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.13 153.98 23.94 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 124.794 2.235 . . . . 1.0 114.377 175.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.5 140.53 37.24 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 106.477 -1.675 . . . . 1.0 106.477 -170.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -99.54 118.08 35.33 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.191 1.796 . . . . 1.0 107.084 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.7 tt -143.84 154.72 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.423 0 C-N-CA 126.595 1.958 . . . . 1.0 109.556 -154.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -116.55 161.16 19.57 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 113.172 -1.831 . . . . 1.0 112.399 -173.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -61.41 -38.02 85.59 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 125.329 1.452 . . . . 1.0 114.707 -164.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -101.08 14.5 31.76 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 124.373 1.069 . . . . 1.0 113.515 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.2 m -86.45 121.48 72.3 Favored Pre-proline 0 CA--C 1.497 -1.065 0 CA-C-O 116.703 -1.618 . . . . 1.0 109.367 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.31 158.95 41.99 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 CA-C-N 125.653 3.055 . . . . 1.0 115.534 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.403 1.3 pp -63.63 -25.57 68.28 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 125.302 1.441 . . . . 1.0 114.404 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -52.72 -29.11 25.05 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.501 -1.374 . . . . 1.0 114.222 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -42.69 68.86 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.442 -1.411 . . . . 1.0 111.524 -176.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.67 -37.14 84.17 Favored 'General case' 0 N--CA 1.434 -1.239 0 O-C-N 120.467 -1.396 . . . . 1.0 113.283 171.12 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.8 ttm -61.94 -42.63 99.33 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 119.83 -1.794 . . . . 1.0 113.872 175.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -43.57 98.45 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.746 1.26 . . . . 1.0 112.326 175.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.13 89.94 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 125.506 1.522 . . . . 1.0 113.837 177.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -61.03 -42.38 98.36 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 125.626 1.57 . . . . 1.0 111.561 172.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.2 m -63.57 -43.17 97.8 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.915 -1.116 . . . . 1.0 113.528 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.56 -48.78 63.37 Favored 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 124.36 1.064 . . . . 1.0 113.394 177.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -73.6 -43.02 60.76 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 116.537 2.051 . . . . 1.0 116.537 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -112.9 10.15 18.96 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.957 -1.089 . . . . 1.0 111.883 -165.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.0 43.17 10.05 Favored Glycine 0 CA--C 1.494 -1.246 0 N-CA-C 117.869 1.908 . . . . 1.0 117.869 160.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.5 mt -123.3 161.93 23.67 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 121.1 -1.235 . . . . 1.0 110.556 -168.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.8 m -102.23 133.21 47.48 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 120.137 -1.602 . . . . 1.0 111.084 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.5 tpt -58.68 -39.33 80.38 Favored 'General case' 0 N--CA 1.437 -1.112 0 N-CA-C 116.662 2.097 . . . . 1.0 116.662 -167.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -92.57 1.47 57.24 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.565 -1.334 . . . . 1.0 112.588 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -100.14 -21.82 15.41 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 124.486 1.114 . . . . 1.0 112.601 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.8 pt -112.95 149.66 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 124.252 1.021 . . . . 1.0 108.947 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.23 154.99 49.07 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.837 -1.164 . . . . 1.0 109.102 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -115.08 147.28 40.38 Favored 'General case' 0 N--CA 1.434 -1.243 0 O-C-N 120.934 -1.104 . . . . 1.0 110.613 -173.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 58.9 mtm180 -130.94 161.06 32.73 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 121.212 -0.93 . . . . 1.0 110.95 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -131.91 114.52 14.75 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.083 0.468 . . . . 1.0 109.99 164.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 t0 53.79 42.36 31.79 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 127.311 2.244 . . . . 1.0 114.066 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.95 0.78 83.27 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 124.978 1.275 . . . . 1.0 115.761 -176.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -99.9 137.6 20.18 Favored Pre-proline 0 N--CA 1.434 -1.242 0 O-C-N 120.337 -1.684 . . . . 1.0 109.53 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.97 137.66 24.57 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 CA-C-N 122.873 2.062 . . . . 1.0 112.127 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 19.4 pt -118.42 140.52 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.14 0 N-CA-C 106.011 -1.848 . . . . 1.0 106.011 177.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -106.64 161.52 14.57 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.163 -1.585 . . . . 1.0 109.711 -166.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -57.79 -34.97 70.19 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.403 -2.06 . . . . 1.0 115.532 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -78.55 -12.64 60.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.282 1.033 . . . . 1.0 113.145 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -74.04 170.52 15.27 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 119.475 -2.015 . . . . 1.0 111.66 177.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 63.9 p -148.02 162.31 31.51 Favored Pre-proline 0 CA--C 1.499 -0.992 0 O-C-N 119.065 -2.272 . . . . 1.0 112.746 -153.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_exo -55.04 -36.52 92.95 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 124.389 3.393 . . . . 1.0 115.857 163.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.55 -45.6 89.77 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 119.556 1.071 . . . . 1.0 113.639 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.61 -44.97 76.78 Favored 'General case' 0 N--CA 1.432 -1.345 0 C-N-CA 124.706 1.202 . . . . 1.0 112.624 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -90.6 -8.5 49.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 120.527 -1.358 . . . . 1.0 113.15 -176.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 69.48 37.79 1.91 Allowed 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 128.573 2.749 . . . . 1.0 114.675 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 52.5 mtt -58.19 152.76 16.4 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 128.326 2.65 . . . . 1.0 115.593 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.3 178.32 5.42 Favored 'General case' 0 N--CA 1.433 -1.307 0 O-C-N 121.139 -0.976 . . . . 1.0 109.666 -167.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.346 14.3 p-10 -54.38 -26.56 30.92 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 117.246 2.313 . . . . 1.0 117.246 -174.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -136.66 62.03 1.62 Allowed 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.52 1.528 . . . . 1.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.63 166.45 20.71 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 119.203 -2.186 . . . . 1.0 115.21 -177.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.7 m -133.56 121.56 22.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 O-C-N 121.04 -1.037 . . . . 1.0 110.7 -174.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.2 mm -118.67 140.71 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.103 0 C-N-CA 126.954 2.102 . . . . 1.0 109.327 -175.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -110.97 141.73 44.04 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.993 -1.692 . . . . 1.0 109.256 -167.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.1 t -108.49 128.97 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.181 0 CA-C-O 122.41 1.1 . . . . 1.0 109.842 -176.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -116.45 139.67 50.2 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 122.742 1.258 . . . . 1.0 111.159 173.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -96.84 120.32 36.96 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 121.254 -0.904 . . . . 1.0 111.81 -167.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -97.9 -26.72 14.57 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.831 -1.168 . . . . 1.0 110.596 174.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -60.26 146.9 42.13 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.944 1.298 . . . . 1.0 113.52 160.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 t -153.95 160.12 41.96 Favored 'General case' 0 CA--C 1.495 -1.154 0 N-CA-C 107.142 -1.429 . . . . 1.0 107.142 177.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -55.03 170.37 1.54 Allowed Glycine 0 N--CA 1.437 -1.266 0 N-CA-C 118.098 1.999 . . . . 1.0 118.098 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.679 0 O-C-N 120.602 -1.528 . . . . 1.0 110.394 -177.602 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 CA-C-O 119.846 -0.419 . . . . 1.0 112.787 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.27 0.2 OUTLIER -74.91 -51.49 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.114 0 CA-C-N 119.772 1.786 . . . . 1.0 114.601 -175.79 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -108.68 116.57 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 N-CA-C 107.418 -1.327 . . . . 1.0 107.418 -172.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -102.21 110.66 22.68 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.918 -1.739 . . . . 1.0 106.671 167.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.5 pp -108.03 143.33 36.88 Favored 'General case' 0 CA--C 1.498 -1.057 0 O-C-N 120.048 -1.657 . . . . 1.0 113.621 -170.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 45.5 p -94.09 -106.96 0.13 Allowed 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 125.956 1.702 . . . . 1.0 112.148 -170.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 13.1 ttt 79.12 -60.99 0.35 Allowed 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 128.448 2.699 . . . . 1.0 115.9 174.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -161.67 166.49 26.66 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 103.443 -2.799 . . . . 1.0 103.443 176.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 63.13 39.9 9.48 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 127.014 2.126 . . . . 1.0 112.196 -170.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 43.53 -139.83 0.23 Allowed 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 114.415 1.265 . . . . 1.0 114.415 -165.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.277 24.4 tt0 . . . . . 0 C--O 1.26 1.614 0 O-C-N 119.939 -1.726 . . . . 1.0 115.579 170.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 ttt . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 112.29 0.478 . . . . 1.0 112.29 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.04 -44.85 79.17 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 129.039 2.936 . . . . 1.0 112.51 -12.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 55.69 42.06 29.76 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 126.283 1.833 . . . . 1.0 113.156 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.99 131.57 48.03 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 125.415 1.486 . . . . 1.0 114.541 -168.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -89.35 137.24 29.21 Favored Pre-proline 0 N--CA 1.432 -1.331 0 C-N-CA 125.038 1.335 . . . . 1.0 109.976 176.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -100.38 60.21 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.555 0 CA-C-N 124.056 2.484 . . . . 1.0 109.864 -161.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 56.65 50.27 13.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 126.29 1.836 . . . . 1.0 114.692 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -67.74 149.29 50.15 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 126.61 1.964 . . . . 1.0 113.94 177.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.56 -5.44 89.3 Favored Glycine 0 N--CA 1.437 -1.27 0 N-CA-C 116.834 1.494 . . . . 1.0 116.834 -174.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.9 m -60.07 143.46 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 N-CA-C 115.243 1.572 . . . . 1.0 115.243 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.6 mttt 59.45 31.04 20.77 Favored 'General case' 0 CA--C 1.496 -1.101 0 C-N-CA 127.354 2.262 . . . . 1.0 114.215 177.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.5 m 62.76 37.61 12.39 Favored 'General case' 0 N--CA 1.437 -1.087 0 C-N-CA 127.752 2.421 . . . . 1.0 111.038 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 60.62 45.58 10.25 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.475 1.91 . . . . 1.0 114.614 -176.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -138.5 171.32 14.53 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 125.401 1.48 . . . . 1.0 107.341 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -140.09 176.77 8.48 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.553 -1.342 . . . . 1.0 110.18 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -86.89 23.28 1.77 Allowed 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 115.302 1.593 . . . . 1.0 115.302 -161.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -76.59 133.11 39.75 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.337 -1.477 . . . . 1.0 114.526 174.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.2 pt -142.95 160.82 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.299 1 C-N-CA 131.893 4.077 . . . . 1.0 106.096 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -113.89 144.93 42.22 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 117.722 -3.111 . . . . 1.0 110.112 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.95 148.51 51.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 119.036 -2.29 . . . . 1.0 107.689 171.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.6 ptpt -115.03 150.63 35.58 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 119.478 -2.014 . . . . 1.0 111.63 169.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.8 p -119.59 131.57 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 O-C-N 121.062 -1.023 . . . . 1.0 108.822 175.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.62 130.25 51.26 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 122.791 1.281 . . . . 1.0 112.654 -175.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -87.06 -176.3 49.11 Favored Glycine 0 N--CA 1.435 -1.429 0 CA-C-O 123.328 1.516 . . . . 1.0 115.572 -177.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -82.7 -10.92 58.7 Favored 'General case' 0 N--CA 1.435 -1.224 0 O-C-N 120.864 -1.374 . . . . 1.0 113.599 -173.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -99.36 2.16 45.03 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 121.244 -0.91 . . . . 1.0 110.868 167.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 86.7 5.57 81.36 Favored Glycine 0 CA--C 1.493 -1.284 0 O-C-N 119.929 -1.732 . . . . 1.0 115.633 177.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.1 m -70.23 139.46 52.24 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 121.035 -1.274 . . . . 1.0 111.35 172.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.3 p -139.74 136.18 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-O 121.71 0.767 . . . . 1.0 112.031 -166.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -129.21 138.74 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 O-C-N 119.722 -1.861 . . . . 1.0 110.842 167.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.68 146.4 39.87 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-O 124.688 2.185 . . . . 1.0 114.138 176.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.54 140.62 49.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.827 -1.796 . . . . 1.0 107.591 -170.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -100.34 116.54 32.55 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 125.231 1.412 . . . . 1.0 109.491 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 11.3 tt -141.73 154.85 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.39 0 C-N-CA 128.167 2.587 . . . . 1.0 110.11 -152.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.55 164.28 14.54 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 112.974 -1.921 . . . . 1.0 112.448 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -67.28 -38.07 84.47 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 115.081 1.512 . . . . 1.0 115.081 -165.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -98.11 31.09 2.84 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 124.861 1.264 . . . . 1.0 112.08 174.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.4 m -114.65 111.68 45.99 Favored Pre-proline 0 N--CA 1.436 -1.153 0 O-C-N 120.585 -1.322 . . . . 1.0 107.596 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -62.04 160.17 31.18 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 123.98 3.12 . . . . 1.0 116.432 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.378 2.0 pp -63.89 -25.65 68.25 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 122.941 1.353 . . . . 1.0 114.15 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 t -52.51 -29.21 23.95 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 125.289 1.435 . . . . 1.0 113.896 169.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -66.75 -44.04 82.52 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.124 -1.61 . . . . 1.0 112.876 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.08 -32.2 70.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.493 -1.379 . . . . 1.0 113.101 174.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.0 ttm -60.59 -44.43 96.26 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 120.277 -1.514 . . . . 1.0 114.175 173.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -66.15 -38.25 87.67 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.566 -1.333 . . . . 1.0 113.339 172.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.93 85.31 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 120.179 -1.575 . . . . 1.0 114.048 175.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -62.55 -41.6 99.0 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 125.846 1.658 . . . . 1.0 112.257 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.5 -44.02 97.4 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 125.467 1.507 . . . . 1.0 113.014 171.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -64.9 -50.01 68.21 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.32 -1.487 . . . . 1.0 114.101 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -77.04 -43.34 34.92 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 115.345 1.609 . . . . 1.0 115.345 -177.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -113.44 -0.45 14.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.899 -1.125 . . . . 1.0 112.013 -165.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 2.69 89.15 Favored Glycine 0 CA--C 1.493 -1.283 0 N-CA-C 117.713 1.845 . . . . 1.0 117.713 164.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.45 153.21 37.74 Favored 'General case' 0 N--CA 1.433 -1.31 0 O-C-N 120.856 -1.379 . . . . 1.0 111.993 -170.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.2 m -99.32 127.73 45.37 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 120.724 -1.235 . . . . 1.0 109.442 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.6 ptp -66.53 -20.79 66.11 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.036 -1.665 . . . . 1.0 115.133 -174.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptt85 -75.75 -11.07 59.92 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 124.57 1.148 . . . . 1.0 114.019 170.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -109.38 -8.37 15.07 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.336 -1.477 . . . . 1.0 113.594 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.1 pt -128.49 150.19 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.16 0 O-C-N 120.128 -1.607 . . . . 1.0 109.99 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.24 150.0 46.29 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 107.959 -1.126 . . . . 1.0 107.959 170.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -108.38 144.58 35.76 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 121.206 -0.934 . . . . 1.0 109.676 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -134.13 159.1 41.9 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 122.48 1.133 . . . . 1.0 111.24 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -139.1 123.55 18.29 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 108.048 -1.094 . . . . 1.0 108.048 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 56.27 38.39 29.74 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 126.211 1.804 . . . . 1.0 113.351 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.28 2.73 84.42 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 116.287 1.275 . . . . 1.0 116.287 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -116.13 140.62 26.6 Favored Pre-proline 0 N--CA 1.435 -1.196 0 CA-C-N 120.094 1.947 . . . . 1.0 109.642 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -48.82 135.3 28.5 Favored 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 124.155 3.237 . . . . 1.0 117.245 169.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 pt -117.93 138.19 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.242 0 N-CA-C 106.329 -1.73 . . . . 1.0 106.329 169.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -104.12 167.14 9.95 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 121.096 -1.003 . . . . 1.0 109.887 -162.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -78.14 -16.54 57.85 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.032 -2.293 . . . . 1.0 111.259 -176.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.21 -13.83 59.45 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 130.959 3.703 . . . . 1.0 113.607 167.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -86.08 169.61 12.99 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 119.639 -1.913 . . . . 1.0 111.361 171.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.2 p -151.51 161.15 30.47 Favored Pre-proline 0 CA--C 1.496 -1.1 0 O-C-N 120.201 -1.562 . . . . 1.0 110.612 -158.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -58.42 -31.56 94.34 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 C-N-CA 123.846 3.031 . . . . 1.0 115.32 167.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.44 -46.07 74.2 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 119.544 1.065 . . . . 1.0 113.033 172.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -69.31 -37.73 77.91 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 124.499 1.12 . . . . 1.0 113.755 -176.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -95.18 -0.63 53.03 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 120.807 -1.183 . . . . 1.0 111.86 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 56.15 42.61 28.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 127.541 2.336 . . . . 1.0 115.86 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.8 mtt -59.84 149.42 31.41 Favored 'General case' 0 N--CA 1.434 -1.275 0 C-N-CA 127.126 2.17 . . . . 1.0 113.748 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -109.67 -172.38 2.03 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 121.358 -0.839 . . . . 1.0 109.113 -165.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.363 14.0 p-10 -60.21 -26.47 66.42 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.045 -1.659 . . . . 1.0 115.119 176.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -143.61 87.51 1.94 Allowed 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 124.416 1.087 . . . . 1.0 110.426 170.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.44 169.29 11.19 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 114.794 1.405 . . . . 1.0 114.794 178.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.3 m -136.45 123.13 21.06 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 124.874 1.269 . . . . 1.0 109.822 -175.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.8 mm -121.47 140.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 126.297 1.839 . . . . 1.0 108.883 -175.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -110.91 141.76 43.9 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.049 -1.657 . . . . 1.0 108.891 -171.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -108.59 139.63 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.142 0 O-C-N 120.522 -1.361 . . . . 1.0 109.542 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -124.45 137.46 54.44 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 122.206 1.003 . . . . 1.0 108.959 167.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -81.88 133.3 35.31 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.355 1.062 . . . . 1.0 112.228 -174.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -131.37 173.5 11.01 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 124.972 1.309 . . . . 1.0 111.029 -174.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -148.94 -14.16 0.31 Allowed 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 115.431 1.641 . . . . 1.0 115.431 -176.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 75.9 p -100.23 7.15 44.66 Favored 'General case' 0 CA--C 1.497 -1.077 0 O-C-N 119.508 -1.995 . . . . 1.0 114.492 -175.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -81.36 -4.68 90.39 Favored Glycine 0 CA--C 1.494 -1.263 0 N-CA-C 116.877 1.511 . . . . 1.0 116.877 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.683 0 O-C-N 120.806 -1.408 . . . . 1.0 110.916 -179.692 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.914 0 N-CA-C 114.076 0.39 . . . . 1.0 114.076 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.272 0.2 OUTLIER -74.86 -48.25 34.02 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.137 0 O-C-N 120.235 -1.744 . . . . 1.0 115.145 -172.439 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.1 mt -110.53 123.88 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 C-N-CA 124.218 1.007 . . . . 1.0 108.97 -170.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -102.14 105.63 16.36 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.52 -1.362 . . . . 1.0 108.294 165.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.9 pp -108.04 161.34 15.04 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.624 -1.297 . . . . 1.0 113.022 -178.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 12.0 t -122.68 -177.48 3.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.063 1.345 . . . . 1.0 109.805 178.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.322 40.6 ttp 116.52 92.3 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.103 0 C-N-CA 130.069 3.348 . . . . 1.0 115.472 168.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 41.6 p-10 -173.68 -54.7 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 126.58 1.952 . . . . 1.0 110.586 169.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -152.95 20.51 0.59 Allowed 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 127.076 2.151 . . . . 1.0 108.661 -174.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . 0.268 11.1 tp10 67.96 -81.21 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.258 0 C-N-CA 128.477 2.711 . . . . 1.0 112.434 -161.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.259 29.8 tt0 . . . . . 0 C--O 1.262 1.727 0 C-N-CA 125.629 1.572 . . . . 1.0 114.91 172.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 120.447 0.165 . . . . 1.0 110.59 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.8 -35.21 74.64 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 120.049 -1.657 . . . . 1.0 114.968 176.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -61.56 146.26 49.38 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 115.042 1.497 . . . . 1.0 115.042 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -124.42 132.82 53.51 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.912 -1.117 . . . . 1.0 111.638 179.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.91 153.02 94.95 Favored Pre-proline 0 N--CA 1.436 -1.145 0 N-CA-C 116.58 2.067 . . . . 1.0 116.58 -175.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -46.16 142.8 8.26 Favored 'Trans proline' 0 N--CA 1.442 -1.516 0 C-N-CA 124.819 3.679 . . . . 1.0 118.64 161.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -84.15 149.29 26.27 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 124.447 1.099 . . . . 1.0 113.52 178.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -157.55 175.23 14.22 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.716 -1.24 . . . . 1.0 111.971 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 78.38 171.56 38.94 Favored Glycine 0 N--CA 1.436 -1.327 0 O-C-N 120.456 -1.403 . . . . 1.0 114.776 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.257 2.9 t 51.96 58.14 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.101 0 C-N-CA 126.82 2.048 . . . . 1.0 114.139 -178.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -88.0 63.16 7.2 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 119.377 -2.077 . . . . 1.0 112.675 -171.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 52.3 p -101.72 6.33 41.77 Favored 'General case' 0 CA--C 1.497 -1.068 0 C-N-CA 127.131 2.173 . . . . 1.0 112.88 -172.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.27 -40.18 93.15 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 127.443 2.297 . . . . 1.0 115.78 -170.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -137.15 -21.56 1.2 Allowed 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 124.039 0.935 . . . . 1.0 111.676 -175.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -124.45 123.36 39.98 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.603 1.161 . . . . 1.0 108.541 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -156.94 163.97 38.55 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 107.178 -1.415 . . . . 1.0 107.178 -178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.5 135.42 45.67 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 116.295 1.961 . . . . 1.0 116.295 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.4 pt -138.06 160.78 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 129.132 2.973 . . . . 1.0 105.316 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -111.75 144.9 40.27 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.252 -2.155 . . . . 1.0 108.832 177.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -129.43 156.13 44.59 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 119.474 -2.016 . . . . 1.0 106.331 170.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.58 150.58 45.77 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 119.433 -2.042 . . . . 1.0 111.453 166.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 p -118.27 137.95 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 N-CA-C 108.377 -0.972 . . . . 1.0 108.377 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.88 130.2 49.71 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 121.356 -0.84 . . . . 1.0 112.498 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.98 168.02 30.03 Favored Glycine 0 N--CA 1.436 -1.364 0 CA-C-O 122.333 0.963 . . . . 1.0 114.587 -178.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 51.41 29.43 5.23 Favored 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 128.678 2.791 . . . . 1.0 117.058 175.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 61.65 26.15 15.89 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 126.445 1.898 . . . . 1.0 113.732 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.21 -16.68 0.02 OUTLIER Glycine 0 N--CA 1.435 -1.38 0 O-C-N 120.208 -1.558 . . . . 1.0 116.578 -177.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.1 t -90.45 128.12 36.42 Favored 'General case' 0 CA--C 1.494 -1.193 0 O-C-N 120.262 -1.728 . . . . 1.0 109.197 176.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.0 p -138.56 126.78 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 121.89 0.852 . . . . 1.0 108.853 163.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.292 0.3 OUTLIER -129.42 138.75 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 O-C-N 120.4 -1.437 . . . . 1.0 111.717 173.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.06 149.91 39.52 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 124.058 1.885 . . . . 1.0 115.022 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.49 140.58 31.91 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.534 -1.354 . . . . 1.0 108.974 -162.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -104.22 115.84 31.12 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 125.283 1.433 . . . . 1.0 113.172 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 13.5 tt -141.32 154.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-O 124.614 2.15 . . . . 1.0 111.576 -154.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -93.7 153.98 18.05 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 112.272 -2.24 . . . . 1.0 113.504 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 68.9 mtt-85 -69.8 -38.17 76.55 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 115.783 1.772 . . . . 1.0 115.783 -172.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -101.43 33.99 2.74 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.29 -1.506 . . . . 1.0 112.367 -174.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.32 155.11 80.54 Favored Pre-proline 0 CA--C 1.496 -1.114 0 O-C-N 120.601 -1.312 . . . . 1.0 108.119 -173.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -78.12 149.85 25.69 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 CA-C-N 124.241 2.55 . . . . 1.0 114.351 -167.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.336 2.1 pp -61.02 -25.53 66.98 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 125.876 1.67 . . . . 1.0 114.512 172.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 92.3 p -52.7 -29.04 24.54 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 119.366 -2.083 . . . . 1.0 113.823 171.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.466 ' HZ3' ' HB3' ' B' ' 971' ' ' MET . 11.3 ttpt -65.33 -40.88 94.27 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.632 -1.293 . . . . 1.0 112.74 -174.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.9 -37.73 84.93 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.609 -1.307 . . . . 1.0 113.686 167.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 54.7 ttm -60.81 -42.12 97.04 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.097 -1.627 . . . . 1.0 113.908 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.83 -43.33 99.09 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.909 -1.119 . . . . 1.0 112.395 174.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.41 83.82 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.528 -1.358 . . . . 1.0 114.477 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -60.2 -42.76 95.76 Favored 'General case' 0 N--CA 1.436 -1.161 0 C-N-CA 125.959 1.704 . . . . 1.0 112.033 174.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.4 m -62.15 -41.65 98.49 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 124.793 1.237 . . . . 1.0 113.791 176.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.99 -47.29 75.04 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 114.289 1.218 . . . . 1.0 114.289 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -75.86 -42.99 47.81 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 116.185 1.92 . . . . 1.0 116.185 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -114.07 11.89 17.78 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.868 -1.145 . . . . 1.0 112.551 -161.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.34 43.71 19.43 Favored Glycine 0 CA--C 1.494 -1.244 0 N-CA-C 117.078 1.591 . . . . 1.0 117.078 164.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.4 mt -124.63 156.5 37.4 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 124.334 1.054 . . . . 1.0 111.154 -169.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.5 m -102.2 131.35 48.79 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.543 -1.348 . . . . 1.0 111.01 170.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -65.02 -24.5 67.52 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 116.317 1.969 . . . . 1.0 116.317 -170.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -89.69 -3.46 58.21 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.258 -1.526 . . . . 1.0 112.848 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -100.87 -15.91 17.42 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.715 -1.241 . . . . 1.0 111.849 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.2 pt -114.42 147.09 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 C-N-CA 125.312 1.445 . . . . 1.0 108.322 174.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -137.75 152.22 48.98 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.154 -1.424 . . . . 1.0 107.154 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.8 m-30 -109.4 148.59 30.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-O 123.079 1.418 . . . . 1.0 109.956 -173.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -139.62 140.97 37.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 108.023 -1.103 . . . . 1.0 108.023 -168.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -127.01 115.96 20.02 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.12 -1.437 . . . . 1.0 107.12 171.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t70 59.16 40.11 22.14 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 125.48 1.512 . . . . 1.0 114.117 171.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.71 5.17 90.15 Favored Glycine 0 N--CA 1.438 -1.216 0 N-CA-C 116.173 1.229 . . . . 1.0 116.173 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -117.17 136.67 23.45 Favored Pre-proline 0 N--CA 1.433 -1.278 0 O-C-N 120.291 -1.711 . . . . 1.0 109.97 -173.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -58.51 137.46 80.44 Favored 'Trans proline' 0 N--CA 1.44 -1.631 0 C-N-CA 123.539 2.826 . . . . 1.0 114.558 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.0 pt -117.13 135.68 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 N-CA-C 106.206 -1.776 . . . . 1.0 106.206 171.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -100.59 163.9 12.14 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.363 -1.461 . . . . 1.0 110.232 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.87 -17.55 61.52 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 119.053 -2.279 . . . . 1.0 113.598 -178.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 98.9 m -78.6 -19.78 51.96 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 125.665 1.586 . . . . 1.0 112.53 167.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -76.61 170.7 15.93 Favored 'General case' 0 N--CA 1.432 -1.355 0 O-C-N 119.702 -1.874 . . . . 1.0 112.153 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 77.2 p -149.25 159.07 37.7 Favored Pre-proline 0 CA--C 1.495 -1.154 0 O-C-N 119.861 -1.775 . . . . 1.0 109.556 -158.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -58.04 -35.05 99.04 Favored 'Trans proline' 0 N--CA 1.439 -1.69 0 C-N-CA 123.334 2.689 . . . . 1.0 114.94 168.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.97 83.26 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 113.916 1.08 . . . . 1.0 113.916 176.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -68.94 -42.52 76.62 Favored 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 124.845 1.258 . . . . 1.0 113.56 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -86.01 -8.47 57.93 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 121.926 0.87 . . . . 1.0 111.073 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 66.7 44.35 2.21 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 127.196 2.199 . . . . 1.0 114.259 175.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 60.3 mtt -62.05 154.24 27.38 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 128.598 2.759 . . . . 1.0 113.398 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -113.3 178.23 4.35 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 107.981 -1.118 . . . . 1.0 107.981 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.459 10.2 p-10 -54.23 -26.5 28.9 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 117.164 2.283 . . . . 1.0 117.164 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -138.28 58.5 1.67 Allowed 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 125.887 1.675 . . . . 1.0 112.069 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.89 161.61 29.59 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 116.233 1.938 . . . . 1.0 116.233 -171.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 61.2 m -129.04 116.42 19.28 Favored 'General case' 0 CA--C 1.497 -1.065 0 C-N-CA 125.011 1.325 . . . . 1.0 111.971 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.7 mm -120.74 140.91 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 C-N-CA 127.974 2.51 . . . . 1.0 109.842 -170.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -110.93 143.86 40.91 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 119.528 -1.983 . . . . 1.0 108.918 -167.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.4 t -108.66 126.25 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.214 0 O-C-N 120.955 -1.091 . . . . 1.0 108.762 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -113.6 134.84 54.48 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 123.403 1.573 . . . . 1.0 107.543 172.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -106.33 124.65 49.92 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.923 -1.111 . . . . 1.0 110.751 -161.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -108.68 -10.76 15.15 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 120.777 -1.202 . . . . 1.0 112.597 -174.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -16.65 121.14 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 130.529 3.532 . . . . 1.0 119.483 175.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . 0.28 6.3 m 65.15 53.04 1.39 Allowed 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 126.885 2.074 . . . . 1.0 111.677 -176.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -112.88 -18.83 7.16 Favored Glycine 0 CA--C 1.493 -1.318 0 O-C-N 121.262 -0.899 . . . . 1.0 113.97 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.805 0 CA-C-O 118.393 -1.226 . . . . 1.0 111.425 177.118 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 N-CA-C 113.485 0.154 . . . . 1.0 113.485 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -74.84 -46.6 40.54 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 N-CA-C 115.285 1.587 . . . . 1.0 115.285 -165.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.4 mt -113.08 119.01 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 C-N-CA 125.11 1.364 . . . . 1.0 110.18 -173.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -102.02 115.65 31.0 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.06 -1.65 . . . . 1.0 106.808 165.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.0 166.29 10.83 Favored 'General case' 0 CA--C 1.497 -1.072 0 CA-C-N 121.667 2.031 . . . . 1.0 114.581 -174.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 4.0 t -146.81 179.99 7.19 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.55 1.14 . . . . 1.0 110.531 -175.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 971' ' ' MET . . . . . 0.466 ' HB3' ' HZ3' ' A' ' 42' ' ' LYS . 42.3 ttp 101.72 50.88 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.043 0 C-N-CA 130.732 3.613 . . . . 1.0 107.728 -156.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . 0.425 ' CG ' ' HZ1' ' A' ' 42' ' ' LYS . 28.5 m-20 -153.97 -10.97 0.14 Allowed 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 114.026 1.121 . . . . 1.0 114.026 -163.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 59.8 -176.76 0.1 Allowed 'General case' 0 N--CA 1.435 -1.177 0 CA-C-O 122.532 1.158 . . . . 1.0 113.329 -155.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.61 134.04 47.25 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 119.453 -2.029 . . . . 1.0 114.164 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.619 0 C-N-CA 125.396 1.478 . . . . 1.0 111.993 177.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 119.302 -0.38 . . . . 1.0 110.771 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.46 7.86 36.67 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 119.616 -1.927 . . . . 1.0 112.946 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.42 -38.04 89.61 Favored 'General case' 0 N--CA 1.433 -1.289 0 C-N-CA 125.88 1.672 . . . . 1.0 114.704 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -122.76 152.22 40.84 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.74 -1.225 . . . . 1.0 109.977 171.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -64.74 152.18 90.81 Favored Pre-proline 0 N--CA 1.435 -1.215 0 C-N-CA 126.743 2.017 . . . . 1.0 113.871 -175.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -44.16 141.85 4.47 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 125.02 3.813 . . . . 1.0 118.223 173.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -65.21 128.12 34.49 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 113.068 0.766 . . . . 1.0 113.068 173.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 59.44 37.19 23.19 Favored 'General case' 0 N--CA 1.436 -1.13 0 C-N-CA 126.656 1.982 . . . . 1.0 116.03 -177.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.28 160.13 13.71 Favored Glycine 0 N--CA 1.438 -1.203 0 N-CA-C 117.031 1.572 . . . . 1.0 117.031 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.6 t -122.42 137.22 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.123 0 C-N-CA 124.659 1.184 . . . . 1.0 109.983 -177.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -134.01 171.5 14.11 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 125.441 1.496 . . . . 1.0 108.68 -176.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.8 m -67.35 128.02 34.84 Favored 'General case' 0 N--CA 1.439 -1.018 0 O-C-N 119.983 -1.698 . . . . 1.0 111.137 168.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -107.29 25.19 11.73 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 119.91 -1.743 . . . . 1.0 112.347 -168.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -62.65 -30.85 71.68 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 126.471 1.908 . . . . 1.0 115.496 -176.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -99.76 0.61 42.02 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.604 -1.31 . . . . 1.0 112.48 178.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -91.49 20.39 5.37 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 115.712 1.745 . . . . 1.0 115.712 -160.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 -56.23 145.19 27.29 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 117.141 2.274 . . . . 1.0 117.141 173.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.3 pt -129.57 160.66 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 129.346 3.058 . . . . 1.0 106.153 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.75 144.79 44.98 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.925 -2.985 . . . . 1.0 111.027 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -131.52 151.38 51.63 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.286 -2.134 . . . . 1.0 107.992 170.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt -121.38 150.61 41.23 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 119.908 -1.745 . . . . 1.0 110.697 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.52 131.9 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 N-CA-C 108.314 -0.995 . . . . 1.0 108.314 174.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.75 132.43 54.61 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 124.759 1.224 . . . . 1.0 111.027 -174.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 160.2 -134.55 3.69 Favored Glycine 0 CA--C 1.49 -1.49 0 N-CA-C 109.236 -1.546 . . . . 1.0 109.236 176.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 38.63 49.84 1.5 Allowed 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 118.252 2.686 . . . . 1.0 118.252 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 70.75 39.76 1.06 Allowed 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 126.499 1.92 . . . . 1.0 112.453 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.87 23.77 19.55 Favored Glycine 0 CA--C 1.492 -1.345 0 C-N-CA 124.586 1.088 . . . . 1.0 114.022 166.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.6 m -107.86 157.76 17.9 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.633 1.573 . . . . 1.0 111.0 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -139.87 137.22 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.143 0 O-C-N 120.523 -1.361 . . . . 1.0 109.501 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.292 0.3 OUTLIER -129.31 138.72 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 O-C-N 119.846 -1.784 . . . . 1.0 111.208 166.4 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.31 147.21 41.77 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-O 125.393 2.521 . . . . 1.0 114.425 176.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -127.23 140.58 52.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.331 -1.729 . . . . 1.0 106.331 -173.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -101.23 115.85 31.44 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.835 2.454 . . . . 1.0 107.164 176.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 9.6 tt -137.7 154.72 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 CA-C-O 125.57 2.605 . . . . 1.0 109.362 -155.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 mtpp -108.74 164.16 12.62 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 110.967 -2.833 . . . . 1.0 111.775 -165.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -59.41 -38.01 79.53 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.989 1.848 . . . . 1.0 115.989 -160.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 -116.65 33.73 5.43 Favored 'General case' 0 N--CA 1.432 -1.35 0 O-C-N 120.958 -1.089 . . . . 1.0 111.759 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.8 m -90.77 124.85 61.1 Favored Pre-proline 0 N--CA 1.438 -1.072 0 O-C-N 120.654 -1.279 . . . . 1.0 109.938 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.73 159.82 52.02 Favored 'Trans proline' 0 N--CA 1.441 -1.615 0 C-N-CA 122.988 2.459 . . . . 1.0 114.615 175.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.359 1.0 OUTLIER -64.99 -25.79 68.01 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 114.805 1.409 . . . . 1.0 114.805 179.841 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.8 p -52.77 -29.24 26.18 Favored 'General case' 0 N--CA 1.437 -1.108 0 O-C-N 120.097 -1.627 . . . . 1.0 115.379 168.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.04 -42.9 68.9 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.042 -1.661 . . . . 1.0 112.572 -175.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.77 -35.68 81.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.67 -1.269 . . . . 1.0 113.527 172.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.9 ttm -61.75 -43.1 99.51 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 120.233 -1.542 . . . . 1.0 113.771 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -42.75 99.3 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 120.926 -1.108 . . . . 1.0 112.969 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.2 86.79 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.515 1.126 . . . . 1.0 113.759 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.38 -42.59 98.96 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.574 1.55 . . . . 1.0 112.212 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.2 m -61.88 -43.69 98.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.528 1.131 . . . . 1.0 113.525 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.58 -48.66 68.89 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.667 1.358 . . . . 1.0 114.667 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.1 -43.18 62.1 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 119.886 -1.759 . . . . 1.0 115.558 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -113.58 8.95 17.85 Favored 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 121.129 -0.982 . . . . 1.0 112.389 -165.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.63 9.84 85.11 Favored Glycine 0 CA--C 1.494 -1.267 0 N-CA-C 116.815 1.486 . . . . 1.0 116.815 162.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.7 mt -81.61 166.34 20.29 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 125.323 1.449 . . . . 1.0 113.238 -174.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -102.21 139.64 37.56 Favored 'General case' 0 CA--C 1.494 -1.21 0 O-C-N 120.563 -1.336 . . . . 1.0 112.245 170.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -29.25 70.63 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.1 1.36 . . . . 1.0 113.484 -178.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.6 ptt180 -95.0 -6.94 41.15 Favored 'General case' 0 N--CA 1.433 -1.291 0 C-N-CA 124.185 0.994 . . . . 1.0 112.771 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -94.6 -22.53 18.12 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.185 -1.572 . . . . 1.0 111.065 174.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 18.9 pt -110.2 145.03 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 CA-C-O 121.475 0.655 . . . . 1.0 112.368 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -138.17 154.95 49.13 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.403 -1.436 . . . . 1.0 109.176 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -115.41 148.67 39.08 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.502 -1.373 . . . . 1.0 112.803 -169.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.75 151.82 48.52 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 126.686 1.994 . . . . 1.0 109.133 175.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -130.84 116.19 17.6 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 108.797 -0.816 . . . . 1.0 108.797 167.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 37.5 t0 55.08 44.07 28.62 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 125.385 1.474 . . . . 1.0 113.31 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.79 2.43 81.36 Favored Glycine 0 N--CA 1.437 -1.288 0 O-C-N 120.314 -1.491 . . . . 1.0 115.924 -177.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -108.93 128.78 24.85 Favored Pre-proline 0 N--CA 1.435 -1.194 0 O-C-N 120.498 -1.59 . . . . 1.0 109.779 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -53.06 135.3 58.73 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 123.469 2.779 . . . . 1.0 116.435 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 pt -119.98 141.4 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.249 -1.389 . . . . 1.0 107.249 174.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.76 160.46 16.71 Favored 'General case' 0 N--CA 1.435 -1.224 0 O-C-N 120.727 -1.233 . . . . 1.0 109.182 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.77 -30.07 70.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 119.82 -1.8 . . . . 1.0 114.14 -173.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.1 m -96.58 6.25 49.1 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.36 1.464 . . . . 1.0 112.489 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -71.2 178.84 3.11 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 118.411 -2.68 . . . . 1.0 113.205 173.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.0 p -120.79 151.96 55.32 Favored Pre-proline 0 CA--C 1.498 -1.019 0 O-C-N 120.151 -1.593 . . . . 1.0 113.557 -161.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -56.4 -30.83 83.14 Favored 'Trans proline' 0 N--CA 1.442 -1.5 0 C-N-CA 123.806 3.004 . . . . 1.0 116.637 170.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.99 87.97 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 114.141 1.163 . . . . 1.0 114.141 173.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.21 -36.76 82.37 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 126.414 1.886 . . . . 1.0 112.793 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.3 tp -81.6 -8.49 59.72 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-O 122.795 1.283 . . . . 1.0 111.399 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 56.58 48.26 16.93 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 127.048 2.139 . . . . 1.0 113.376 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 93.7 mtp -62.19 143.48 56.72 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 115.73 1.752 . . . . 1.0 115.73 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -148.57 179.65 7.65 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 106.103 -1.814 . . . . 1.0 106.103 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.284 2.2 p30 -54.86 -26.57 36.38 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 116.655 2.094 . . . . 1.0 116.655 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -135.19 105.19 6.2 Favored 'General case' 0 N--CA 1.436 -1.166 0 C-N-CA 125.446 1.498 . . . . 1.0 108.219 162.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -100.18 158.73 15.65 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.714 -1.241 . . . . 1.0 112.135 164.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.4 m -136.35 115.29 12.25 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 124.251 1.02 . . . . 1.0 110.57 -176.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 10.0 mm -120.32 140.81 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.962 2.505 . . . . 1.0 109.219 -166.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -110.79 142.27 43.0 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 119.072 -2.268 . . . . 1.0 108.425 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.7 p -120.38 136.71 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.172 0 C-N-CA 125.114 1.366 . . . . 1.0 109.305 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -133.74 145.13 49.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 124.438 1.095 . . . . 1.0 108.067 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -105.83 132.59 51.76 Favored 'General case' 0 N--CA 1.433 -1.278 0 O-C-N 120.551 -1.343 . . . . 1.0 113.28 -169.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -114.14 -7.0 13.05 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 124.974 1.31 . . . . 1.0 112.755 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . 0.333 3.8 pt20 59.41 11.98 2.48 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 119.772 3.249 . . . . 1.0 119.772 172.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 21.5 m -60.62 129.78 43.26 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 116.102 1.89 . . . . 1.0 116.102 -177.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.35 -48.47 4.02 Favored Glycine 0 N--CA 1.436 -1.321 0 C-N-CA 125.078 1.323 . . . . 1.0 116.402 156.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.733 0 C-N-CA 125.173 1.368 . . . . 1.0 110.052 -176.32 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.879 0 N-CA-C 113.733 0.253 . . . . 1.0 113.733 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.333 0.2 OUTLIER -75.83 -54.2 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 116.143 1.905 . . . . 1.0 116.143 179.562 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -112.37 113.47 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 O-C-N 121.51 -0.743 . . . . 1.0 109.495 -168.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.04 122.45 44.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.662 -1.899 . . . . 1.0 109.667 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 66.8 mt -95.58 153.37 17.75 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 115.748 1.758 . . . . 1.0 115.748 -172.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 32.2 p -111.91 -10.11 14.0 Favored 'General case' 0 CA--C 1.497 -1.062 0 C-N-CA 126.461 1.904 . . . . 1.0 112.885 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 27.7 ttt -80.82 120.28 24.47 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 119.965 -1.709 . . . . 1.0 113.242 -177.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . 0.293 27.0 t0 118.24 90.97 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 131.007 3.723 . . . . 1.0 109.827 175.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 69.15 36.66 2.34 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 127.343 2.257 . . . . 1.0 112.732 178.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 47.88 -153.68 0.08 Allowed 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 126.433 1.893 . . . . 1.0 113.514 -167.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 . . . . . 0 N--CA 1.423 -1.814 0 C-N-CA 126.143 1.777 . . . . 1.0 110.602 171.133 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.471 ' H1 ' ' CD ' ' A' ' 81' ' ' GLU . 25.3 ptt? . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 114.187 1.18 . . . . 1.0 114.187 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.02 -42.49 80.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 114.969 1.47 . . . . 1.0 114.969 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -119.78 -139.04 0.34 Allowed 'General case' 0 N--CA 1.433 -1.301 0 C-N-CA 124.863 1.265 . . . . 1.0 107.805 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -99.7 -4.79 30.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.11 -1.619 . . . . 1.0 113.349 -175.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -93.66 126.04 51.31 Favored Pre-proline 0 N--CA 1.435 -1.187 0 O-C-N 120.729 -1.232 . . . . 1.0 113.055 176.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -53.24 165.78 1.3 Allowed 'Trans proline' 0 N--CA 1.442 -1.513 0 C-N-CA 125.273 3.982 . . . . 1.0 118.698 168.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.9 pttt -132.28 169.68 16.13 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.846 0.832 . . . . 1.0 112.36 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -139.6 157.0 46.54 Favored 'General case' 0 N--CA 1.434 -1.257 0 C-N-CA 125.447 1.499 . . . . 1.0 107.365 172.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.06 88.94 Favored Glycine 0 N--CA 1.437 -1.259 0 O-C-N 120.422 -1.424 . . . . 1.0 114.589 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.0 m -108.79 7.32 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 C-N-CA 125.832 1.653 . . . . 1.0 111.934 -177.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -132.25 135.01 45.97 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 106.455 -1.683 . . . . 1.0 106.455 173.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.9 t -151.12 152.15 32.97 Favored 'General case' 0 CA--C 1.496 -1.103 0 CA-C-O 122.457 1.122 . . . . 1.0 110.894 -172.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -92.51 -8.39 44.66 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 124.94 1.296 . . . . 1.0 111.069 174.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 60.34 39.53 18.65 Favored 'General case' 0 N--CA 1.436 -1.159 0 C-N-CA 128.096 2.559 . . . . 1.0 114.914 -178.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -85.1 142.85 29.23 Favored 'General case' 0 N--CA 1.435 -1.176 0 O-C-N 119.804 -1.81 . . . . 1.0 111.418 177.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -102.28 7.42 40.68 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 122.966 1.365 . . . . 1.0 112.626 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -95.7 133.86 39.29 Favored 'General case' 0 N--CA 1.432 -1.357 0 C-N-CA 125.499 1.52 . . . . 1.0 108.957 152.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.6 pt -138.19 160.72 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 C-N-CA 129.975 3.31 . . . . 1.0 106.198 -171.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -117.89 144.89 45.04 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 119.353 -2.092 . . . . 1.0 110.712 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -134.03 160.83 36.56 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 118.761 -2.462 . . . . 1.0 108.334 173.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -131.7 150.66 52.08 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 119.985 -1.697 . . . . 1.0 112.914 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.0 t -119.12 119.28 60.35 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 N-CA-C 107.407 -1.331 . . . . 1.0 107.407 176.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -113.55 130.14 56.42 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.79 0.805 . . . . 1.0 111.918 -170.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -86.95 178.28 48.27 Favored Glycine 0 N--CA 1.433 -1.502 0 CA-C-O 122.948 1.305 . . . . 1.0 115.32 -175.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -85.45 -22.64 28.2 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 124.661 1.185 . . . . 1.0 112.24 -177.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -83.31 -18.14 40.04 Favored 'General case' 0 N--CA 1.433 -1.278 0 O-C-N 120.959 -1.088 . . . . 1.0 111.672 178.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.89 -2.93 6.41 Favored Glycine 0 CA--C 1.492 -1.405 0 O-C-N 120.896 -1.127 . . . . 1.0 114.915 161.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.7 m -109.89 157.73 18.92 Favored 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 119.269 1.535 . . . . 1.0 112.547 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.9 p -139.88 140.98 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 C-N-CA 125.528 1.531 . . . . 1.0 110.176 -165.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.23 138.74 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.119 0 O-C-N 120.868 -1.145 . . . . 1.0 108.983 174.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.479 ' H ' HG22 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -112.68 160.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 126.729 3.157 . . . . 1.0 114.42 179.934 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -145.1 140.64 28.18 Favored 'General case' 0 N--CA 1.428 -1.548 0 O-C-N 118.838 -2.414 . . . . 1.0 107.883 -165.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.277 30.0 ttpt -104.98 115.89 31.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.315 2.246 . . . . 1.0 113.994 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.437 ' HB ' HD13 ' B' ' 969' ' ' LEU . 6.3 tt -142.67 154.67 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.356 0 CA-C-O 124.007 1.86 . . . . 1.0 110.612 -154.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.266 3.7 mppt? -107.19 165.79 11.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 113.843 -1.526 . . . . 1.0 113.668 -175.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -63.28 -38.05 89.66 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 -160.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -99.14 -4.07 33.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.607 -1.308 . . . . 1.0 112.498 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 m -60.45 134.41 91.34 Favored Pre-proline 0 N--CA 1.437 -1.123 0 C-N-CA 126.294 1.838 . . . . 1.0 113.576 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.73 160.73 37.47 Favored 'Trans proline' 0 N--CA 1.441 -1.6 0 C-N-CA 122.867 2.378 . . . . 1.0 113.712 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.375 1.0 OUTLIER -65.58 -25.56 67.46 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 126.101 1.76 . . . . 1.0 114.066 178.613 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.2 p -52.8 -29.02 25.21 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 115.822 1.786 . . . . 1.0 115.822 173.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -65.39 -43.79 89.58 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 119.962 1.256 . . . . 1.0 114.079 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.69 -31.06 68.88 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.052 -1.655 . . . . 1.0 112.693 177.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 tpp -60.43 -43.57 96.66 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 120.703 -1.248 . . . . 1.0 113.7 171.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -61.57 -43.35 99.03 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.696 -1.252 . . . . 1.0 113.381 171.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.38 -34.04 73.94 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.739 -1.85 . . . . 1.0 114.147 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.4 -36.88 79.15 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 127.217 2.207 . . . . 1.0 111.56 170.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 53' ' ' LEU . 77.7 m -69.9 -30.76 68.26 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 127.454 2.302 . . . . 1.0 113.671 170.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -67.07 -52.65 39.45 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 119.12 -2.237 . . . . 1.0 113.386 165.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -78.92 -43.44 24.75 Favored 'General case' 0 N--CA 1.437 -1.117 1 N-CA-C 125.339 5.311 . . . . 1.0 125.339 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -160.98 -18.03 0.05 Allowed 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 119.955 3.317 . . . . 1.0 119.955 -157.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.27 -37.56 4.29 Favored Glycine 0 CA--C 1.492 -1.375 0 O-C-N 118.55 -2.594 . . . . 1.0 110.83 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 48' ' ' CYS 0.884 0.1 OUTLIER 57.16 -28.49 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.397 2 N-CA-C 128.003 6.297 . . . . 1.0 128.003 161.769 . . . . . . . . 5 4 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.8 m -102.4 123.65 46.55 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 105.94 -1.874 . . . . 1.0 105.94 154.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -63.76 -18.52 64.15 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.689 -1.257 . . . . 1.0 112.564 169.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -90.86 -3.52 57.3 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 113.307 0.855 . . . . 1.0 113.307 174.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -82.07 -38.54 24.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 120.009 -1.682 . . . . 1.0 112.527 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.6 pp -128.03 141.95 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.125 0 O-C-N 121.295 -0.878 . . . . 1.0 112.959 -165.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 155.06 48.98 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.549 1.539 . . . . 1.0 108.738 174.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -106.13 144.96 32.1 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.677 -1.264 . . . . 1.0 112.578 -168.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -126.39 145.18 50.56 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 126.284 1.834 . . . . 1.0 112.771 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -116.38 111.74 20.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.657 1.183 . . . . 1.0 108.549 168.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 t70 48.06 50.39 16.06 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 126.72 2.008 . . . . 1.0 114.574 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.73 0.89 89.9 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 117.544 1.778 . . . . 1.0 117.544 -178.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -118.3 133.46 23.49 Favored Pre-proline 0 N--CA 1.435 -1.206 0 CA-C-N 120.549 2.175 . . . . 1.0 110.528 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_exo -48.0 135.22 23.87 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 124.424 3.416 . . . . 1.0 117.55 168.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.6 pt -116.58 154.97 18.13 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 C-N-CA 124.826 1.251 . . . . 1.0 107.849 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -103.33 160.49 14.64 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.927 -1.108 . . . . 1.0 110.096 -175.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -63.18 -28.2 69.89 Favored 'General case' 0 CA--C 1.496 -1.106 0 O-C-N 119.554 -1.966 . . . . 1.0 114.04 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.3 m -92.29 -0.26 57.41 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 120.98 -1.075 . . . . 1.0 112.022 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -67.84 174.59 3.55 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.489 -2.007 . . . . 1.0 113.54 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.6 p -111.01 150.52 42.03 Favored Pre-proline 0 N--CA 1.438 -1.069 0 O-C-N 120.275 -1.515 . . . . 1.0 112.32 -156.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -58.01 -32.98 96.66 Favored 'Trans proline' 0 N--CA 1.44 -1.62 0 C-N-CA 122.959 2.439 . . . . 1.0 115.585 170.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.79 -45.37 82.65 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -66.66 -34.36 77.69 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.755 1.622 . . . . 1.0 113.595 -177.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 42.3 tp -95.33 -5.15 44.12 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.951 1.701 . . . . 1.0 112.023 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 59.47 45.33 13.71 Favored 'General case' 0 N--CA 1.436 -1.131 0 C-N-CA 127.468 2.307 . . . . 1.0 114.817 175.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.0 mtp -65.76 135.96 55.6 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 116.503 2.038 . . . . 1.0 116.503 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -150.48 -173.77 4.56 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.66 1.584 . . . . 1.0 108.516 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -55.77 -26.72 47.25 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 118.157 2.651 . . . . 1.0 118.157 -172.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.471 ' CD ' ' H1 ' ' A' ' 1' ' ' MET . 53.3 mt-10 -141.49 83.15 1.85 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.747 1.219 . . . . 1.0 108.311 167.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -85.59 159.6 19.83 Favored 'General case' 0 CA--C 1.498 -1.058 0 O-C-N 120.667 -1.271 . . . . 1.0 112.538 175.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -127.59 128.2 45.16 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 124.481 1.112 . . . . 1.0 109.843 174.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 77.1 mt -118.31 140.78 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 129.256 3.022 . . . . 1.0 106.605 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -110.75 145.51 37.96 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 119.526 -1.984 . . . . 1.0 105.893 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -108.56 139.73 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.302 0 O-C-N 120.721 -1.237 . . . . 1.0 108.215 -171.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -119.3 135.26 54.79 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-O 123.054 1.407 . . . . 1.0 108.673 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 62.4 tp60 -81.99 120.58 25.43 Favored 'General case' 0 N--CA 1.432 -1.336 0 C-N-CA 125.344 1.458 . . . . 1.0 110.148 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -89.88 -152.69 0.26 Allowed 'General case' 0 N--CA 1.433 -1.311 0 O-C-N 121.295 -0.878 . . . . 1.0 110.847 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 57.97 44.86 19.01 Favored 'General case' 0 N--CA 1.437 -1.079 0 C-N-CA 125.14 1.376 . . . . 1.0 114.024 -175.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 42.3 p -62.85 147.04 51.29 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 115.117 1.525 . . . . 1.0 115.117 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -94.36 -148.44 23.97 Favored Glycine 0 N--CA 1.436 -1.349 0 C-N-CA 124.801 1.191 . . . . 1.0 112.904 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.714 0 O-C-N 121.018 -1.284 . . . . 1.0 111.165 179.241 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.999 0 N-CA-C 112.567 -0.213 . . . . 1.0 112.567 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . 0.479 HG22 ' H ' ' A' ' 31' ' ' GLN . 28.4 t -89.36 -102.63 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 O-C-N 121.078 -1.248 . . . . 1.0 111.943 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . 0.402 ' H ' ' HB ' ' B' ' 966' ' ' VAL . 0.4 OUTLIER -95.44 132.04 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 O-C-N 120.803 -1.185 . . . . 1.0 111.892 -157.092 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -102.0 107.95 19.24 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 125.509 1.524 . . . . 1.0 108.397 173.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . 0.437 HD13 ' HB ' ' A' ' 34' ' ' ILE . 0.5 OUTLIER -108.01 151.33 25.97 Favored 'General case' 0 CA--C 1.494 -1.2 0 O-C-N 119.741 -1.849 . . . . 1.0 114.85 -176.814 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 44.9 p -84.61 174.18 10.18 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 127.513 2.325 . . . . 1.0 111.782 177.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.256 24.3 ttt 89.67 123.29 0.03 OUTLIER 'General case' 0 CA--C 1.496 -1.11 0 C-N-CA 127.891 2.476 . . . . 1.0 111.138 175.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 15.4 t0 66.88 48.42 1.32 Allowed 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.077 1.751 . . . . 1.0 111.787 -164.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -78.06 83.18 4.36 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 117.45 2.389 . . . . 1.0 117.45 -163.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -65.62 -50.18 65.99 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.689 -1.257 . . . . 1.0 111.375 152.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 . . . . . 0 N--CA 1.427 -1.602 0 C-N-CA 127.194 2.197 . . . . 1.0 112.206 176.487 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.1 mmt . . . . . 0 N--CA 1.481 1.113 0 CA-C-O 119.803 -0.142 . . . . 1.0 111.366 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.3 -36.36 81.35 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 119.9 -1.75 . . . . 1.0 114.021 169.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -62.96 -46.84 85.84 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 127.061 2.144 . . . . 1.0 114.817 177.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -155.94 145.63 21.11 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.488 -1.671 . . . . 1.0 106.488 175.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -65.94 147.0 99.0 Favored Pre-proline 0 N--CA 1.437 -1.08 0 O-C-N 120.07 -1.644 . . . . 1.0 114.764 -176.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -75.07 145.98 31.86 Favored 'Trans proline' 0 N--CA 1.44 -1.647 0 C-N-CA 122.614 2.209 . . . . 1.0 112.195 173.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -137.16 168.01 20.44 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 124.605 1.162 . . . . 1.0 110.237 -177.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -59.64 146.51 40.81 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 120.605 -1.309 . . . . 1.0 114.331 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.58 -2.13 84.32 Favored Glycine 0 N--CA 1.436 -1.328 0 N-CA-C 117.313 1.685 . . . . 1.0 117.313 -169.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.1 p -57.02 139.77 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.144 0 C-N-CA 126.682 1.993 . . . . 1.0 115.313 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -117.4 128.69 55.27 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.211 -1.556 . . . . 1.0 109.757 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.5 p -105.67 -1.14 24.91 Favored 'General case' 0 CA--C 1.495 -1.163 0 O-C-N 120.169 -1.582 . . . . 1.0 112.85 -177.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -60.3 154.13 20.87 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 125.703 1.601 . . . . 1.0 114.435 171.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -62.89 149.67 43.9 Favored 'General case' 0 N--CA 1.436 -1.161 0 O-C-N 120.658 -1.276 . . . . 1.0 112.693 171.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -92.72 12.78 22.23 Favored 'General case' 0 N--CA 1.436 -1.151 0 O-C-N 120.213 -1.554 . . . . 1.0 114.66 -165.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.5 p-10 -87.33 -15.1 38.93 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 116.349 1.981 . . . . 1.0 116.349 -172.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.0 p-80 -121.33 161.91 21.23 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 117.475 2.398 . . . . 1.0 117.475 -171.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -132.68 160.73 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 C-N-CA 130.98 3.712 . . . . 1.0 105.096 173.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -112.25 144.77 41.1 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.285 -2.135 . . . . 1.0 109.757 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -137.43 160.44 39.1 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.263 -2.148 . . . . 1.0 105.854 177.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -138.05 150.68 47.14 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 119.556 -1.965 . . . . 1.0 111.416 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.4 HG22 ' CE1' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -108.77 132.82 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.612 0 C-N-CA 125.781 1.632 . . . . 1.0 108.21 174.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.36 130.15 56.33 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 123.976 0.91 . . . . 1.0 109.419 173.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -90.12 -176.51 45.0 Favored Glycine 0 N--CA 1.435 -1.391 0 CA-C-O 122.566 1.092 . . . . 1.0 114.992 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -61.55 -33.63 74.17 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 126.383 1.873 . . . . 1.0 112.869 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -90.83 0.56 57.43 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 120.704 -1.248 . . . . 1.0 112.771 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.92 4.15 90.38 Favored Glycine 0 N--CA 1.436 -1.333 0 O-C-N 120.51 -1.369 . . . . 1.0 115.535 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.5 m -70.32 140.71 52.31 Favored 'General case' 0 CA--C 1.495 -1.158 0 O-C-N 120.593 -1.534 . . . . 1.0 110.872 171.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.4 p -134.01 133.5 56.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 O-C-N 121.326 -0.859 . . . . 1.0 112.231 -169.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.26 0.7 OUTLIER -129.24 138.78 53.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 O-C-N 120.056 -1.653 . . . . 1.0 111.616 166.897 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.477 ' O ' ' HB ' ' B' ' 966' ' ' VAL . 0.0 OUTLIER -107.1 161.6 14.61 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 126.629 3.109 . . . . 1.0 115.686 173.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.4 ' CE1' HG22 ' A' ' 22' ' ' VAL . 3.6 m-85 -145.11 157.65 44.04 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.255 -2.778 . . . . 1.0 107.139 -173.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.268 24.1 ttpt -120.52 115.85 24.25 Favored 'General case' 0 N--CA 1.434 -1.238 0 C-N-CA 124.813 1.245 . . . . 1.0 109.686 -176.468 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.408 ' CG1' ' H ' ' A' ' 35' ' ' LYS . 18.6 tt -148.56 154.74 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 CA-C-O 125.121 2.391 . . . . 1.0 112.028 -162.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.408 ' H ' ' CG1' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -90.49 163.29 14.69 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 111.476 -2.602 . . . . 1.0 111.741 -177.033 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 71.0 mtt85 -71.29 -37.97 71.82 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 116.441 2.015 . . . . 1.0 116.441 -164.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -98.73 -11.51 21.85 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.581 -1.325 . . . . 1.0 112.33 -175.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.4 m -59.66 137.1 89.82 Favored Pre-proline 0 N--CA 1.435 -1.192 0 C-N-CA 126.291 1.836 . . . . 1.0 112.73 170.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -71.36 155.25 60.51 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 123.642 2.336 . . . . 1.0 114.994 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.399 2.0 pp -62.01 -25.57 67.73 Favored 'General case' 0 N--CA 1.434 -1.273 0 C-N-CA 125.539 1.535 . . . . 1.0 114.67 174.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.0 p -52.64 -29.11 24.46 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.281 -2.137 . . . . 1.0 114.86 170.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.82 -41.73 87.01 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 119.97 -1.707 . . . . 1.0 112.605 -174.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -37.28 84.96 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.78 -1.2 . . . . 1.0 113.85 170.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.0 ttm -60.2 -42.55 95.35 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 120.243 -1.536 . . . . 1.0 113.771 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.96 -43.62 98.47 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.539 -1.351 . . . . 1.0 112.497 172.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.73 -35.12 79.37 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 114.753 1.39 . . . . 1.0 114.753 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.55 -43.81 89.43 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 127.355 2.262 . . . . 1.0 111.767 174.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.8 m -62.25 -42.36 99.26 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 124.907 1.283 . . . . 1.0 113.531 173.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.09 -46.99 72.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 115.054 1.501 . . . . 1.0 115.054 176.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.8 mtt180 -75.6 -43.2 49.34 Favored 'General case' 0 CA--C 1.495 -1.136 0 O-C-N 120.276 -1.515 . . . . 1.0 114.722 178.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -114.98 8.93 15.94 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.12 0.785 . . . . 1.0 113.12 -162.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.14 9.47 86.07 Favored Glycine 0 N--CA 1.437 -1.285 0 N-CA-C 117.355 1.702 . . . . 1.0 117.355 161.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -85.82 162.77 18.5 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 121.321 -1.105 . . . . 1.0 113.446 -174.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.9 m -102.32 129.41 48.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 124.307 1.043 . . . . 1.0 110.307 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -66.54 -22.52 66.16 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 116.47 2.026 . . . . 1.0 116.47 -171.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -90.47 -1.59 57.9 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.317 -1.489 . . . . 1.0 112.759 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -100.49 -10.37 21.16 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.775 -1.203 . . . . 1.0 111.644 177.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -122.92 146.58 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 O-C-N 120.581 -1.324 . . . . 1.0 110.03 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -138.24 154.97 49.06 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.698 -1.223 . . . . 1.0 107.698 171.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -113.97 148.61 36.6 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.655 1.217 . . . . 1.0 110.74 -173.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -137.41 156.89 47.66 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.642 -1.286 . . . . 1.0 108.429 173.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -131.85 113.87 14.0 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 120.987 -1.071 . . . . 1.0 108.522 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 27.0 t0 53.5 46.52 26.0 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 125.534 1.534 . . . . 1.0 113.473 -177.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.65 5.78 86.42 Favored Glycine 0 N--CA 1.436 -1.32 0 O-C-N 120.209 -1.557 . . . . 1.0 116.838 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -119.12 133.14 23.73 Favored Pre-proline 0 N--CA 1.436 -1.136 0 CA-C-N 119.589 1.695 . . . . 1.0 110.137 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -73.43 142.24 32.89 Favored 'Trans proline' 0 C--N 1.308 -1.583 0 CA-C-N 124.173 2.526 . . . . 1.0 113.147 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.0 pt -120.13 145.43 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 C-N-CA 124.931 1.292 . . . . 1.0 109.968 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -109.8 162.89 14.03 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.568 -1.332 . . . . 1.0 111.001 -165.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -70.87 -13.93 62.21 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.738 -1.851 . . . . 1.0 112.796 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -83.07 -14.88 52.89 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 126.874 2.07 . . . . 1.0 112.656 169.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.87 172.24 11.56 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.744 -1.848 . . . . 1.0 111.634 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 82.7 p -147.18 157.25 46.2 Favored Pre-proline 0 CA--C 1.496 -1.097 0 O-C-N 119.962 -1.711 . . . . 1.0 110.202 -162.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -59.85 -32.53 95.49 Favored 'Trans proline' 0 N--CA 1.439 -1.685 0 C-N-CA 123.259 2.639 . . . . 1.0 115.17 170.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.59 -46.05 84.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 113.477 0.918 . . . . 1.0 113.477 175.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -68.22 -39.08 82.46 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.026 1.73 . . . . 1.0 113.355 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 17.4 tp -85.03 -8.47 58.69 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-O 121.809 0.814 . . . . 1.0 113.128 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 64.41 42.47 5.13 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 128.421 2.688 . . . . 1.0 114.996 174.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.73 154.37 39.64 Favored 'General case' 0 N--CA 1.432 -1.328 0 C-N-CA 127.836 2.454 . . . . 1.0 114.29 176.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -126.76 -175.32 3.37 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.488 -1.301 . . . . 1.0 107.488 -168.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.315 8.6 p-10 -56.51 -26.48 54.72 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 117.014 2.227 . . . . 1.0 117.014 -172.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -137.64 92.46 2.69 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 118.503 0.592 . . . . 1.0 111.682 162.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.72 164.8 11.69 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.833 -1.792 . . . . 1.0 115.119 174.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -126.65 120.08 28.61 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 122.52 1.153 . . . . 1.0 112.52 -173.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mt -105.7 140.73 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 C-N-CA 128.772 2.829 . . . . 1.0 109.078 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -110.92 136.08 50.47 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.305 -1.497 . . . . 1.0 107.97 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 36.5 t -115.17 138.93 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 O-C-N 120.96 -1.088 . . . . 1.0 109.546 -171.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -128.03 140.13 52.14 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-O 122.101 0.953 . . . . 1.0 110.391 172.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -90.24 126.69 35.92 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.269 1.028 . . . . 1.0 111.471 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -86.71 175.3 8.33 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 116.178 1.918 . . . . 1.0 116.178 -167.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.5 tp-100 -137.66 128.19 26.64 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 123.594 0.758 . . . . 1.0 110.863 -178.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.2 t -153.78 150.78 28.84 Favored 'General case' 0 CA--C 1.496 -1.105 0 O-C-N 120.486 -1.384 . . . . 1.0 110.13 174.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -80.51 -4.36 90.1 Favored Glycine 0 N--CA 1.436 -1.329 0 O-C-N 120.536 -1.352 . . . . 1.0 114.69 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.678 0 O-C-N 121.067 -1.255 . . . . 1.0 111.211 175.965 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.84 0 N-CA-C 114.889 0.716 . . . . 1.0 114.889 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . 0.477 ' HB ' ' O ' ' A' ' 31' ' ' GLN . 34.2 t -90.48 -108.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 124.579 1.152 . . . . 1.0 109.959 174.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -90.83 130.61 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 O-C-N 120.881 -1.137 . . . . 1.0 111.37 -155.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -102.07 121.9 43.08 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.177 -1.577 . . . . 1.0 111.663 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.03 140.57 40.99 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.734 -1.228 . . . . 1.0 112.704 177.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 41.4 p -127.95 -25.67 3.02 Favored 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 124.286 1.034 . . . . 1.0 112.045 174.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.327 12.9 ttt 17.0 -109.61 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.031 0 C-N-CA 129.941 3.296 . . . . 1.0 119.199 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -147.64 -172.25 3.99 Favored 'General case' 0 N--CA 1.433 -1.323 0 N-CA-C 106.875 -1.528 . . . . 1.0 106.875 -172.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 69.07 16.07 8.69 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 117.652 2.464 . . . . 1.0 117.652 171.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 40.45 -125.09 0.45 Allowed 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 125.758 1.623 . . . . 1.0 113.692 -167.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.426 -1.664 0 C-N-CA 127.549 2.34 . . . . 1.0 116.662 175.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.3 ptt? . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 114.294 1.22 . . . . 1.0 114.294 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.26 91.52 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 115.113 1.523 . . . . 1.0 115.113 -174.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -61.17 -28.74 69.35 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 115.253 1.575 . . . . 1.0 115.253 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.51 -39.17 91.52 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 124.721 1.208 . . . . 1.0 113.775 173.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -67.55 144.17 97.54 Favored Pre-proline 0 N--CA 1.435 -1.222 0 N-CA-C 114.997 1.48 . . . . 1.0 114.997 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.11 146.84 4.09 Favored 'Trans proline' 0 N--CA 1.443 -1.461 0 C-N-CA 125.121 3.881 . . . . 1.0 117.851 169.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -84.03 -15.01 49.15 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.904 -1.123 . . . . 1.0 113.828 -169.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -113.43 11.92 18.59 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.339 1.456 . . . . 1.0 111.386 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 77.37 169.99 33.31 Favored Glycine 0 N--CA 1.436 -1.327 0 O-C-N 120.503 -1.373 . . . . 1.0 116.522 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.6 p -126.36 130.56 71.92 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 124.666 1.186 . . . . 1.0 110.892 -172.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt 59.12 37.84 23.99 Favored 'General case' 0 N--CA 1.435 -1.182 0 C-N-CA 126.852 2.061 . . . . 1.0 114.198 -176.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 45.2 p -115.79 23.76 12.04 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 125.634 1.573 . . . . 1.0 110.378 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -91.22 -4.53 55.92 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 120.372 -1.455 . . . . 1.0 112.561 -169.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.0 m120 55.79 -169.57 0.08 Allowed 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 127.904 2.482 . . . . 1.0 114.888 -175.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -120.72 14.16 11.69 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.099 -1.626 . . . . 1.0 114.383 -166.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -90.04 96.11 10.52 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 119.936 -1.728 . . . . 1.0 111.55 -169.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -73.92 135.27 43.26 Favored 'General case' 0 N--CA 1.435 -1.189 0 N-CA-C 115.123 1.527 . . . . 1.0 115.123 -179.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.409 ' HB ' ' HA ' ' A' ' 80' ' ' ASP . 19.9 pt -134.54 160.7 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 C-N-CA 129.489 3.115 . . . . 1.0 105.045 174.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -117.8 144.74 45.08 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 119.286 -2.134 . . . . 1.0 109.717 175.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.97 157.51 43.89 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 119.531 -1.98 . . . . 1.0 108.495 166.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -119.02 150.62 39.65 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-O 122.795 1.283 . . . . 1.0 113.274 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.32 133.08 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 107.567 -1.272 . . . . 1.0 107.567 173.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -142.82 140.57 31.36 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.796 1.284 . . . . 1.0 114.371 -163.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 150.89 -152.63 24.42 Favored Glycine 0 CA--C 1.493 -1.32 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.739 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 53.77 48.3 21.73 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 116.57 2.063 . . . . 1.0 116.57 171.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 70.68 38.61 1.23 Allowed 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 127.951 2.501 . . . . 1.0 111.715 178.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.03 26.59 25.93 Favored Glycine 0 N--CA 1.435 -1.42 0 O-C-N 121.194 -0.941 . . . . 1.0 113.95 173.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.0 m -90.59 127.79 36.38 Favored 'General case' 0 CA--C 1.495 -1.148 0 O-C-N 120.912 -1.346 . . . . 1.0 109.721 165.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.4 t -139.91 133.09 35.57 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 N-CA-C 107.82 -1.178 . . . . 1.0 107.82 -178.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.403 HG21 ' CD1' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -129.14 135.02 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 119.681 -1.887 . . . . 1.0 108.535 161.478 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.71 145.04 26.16 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 123.298 1.523 . . . . 1.0 112.785 159.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -138.92 140.61 38.39 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.946 -1.096 . . . . 1.0 108.747 -164.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.431 31.3 ttpt -113.48 115.29 27.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.896 1.808 . . . . 1.0 111.798 -169.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.8 tp -142.68 154.86 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.484 0 CA-C-N 110.935 -2.848 . . . . 1.0 111.799 -153.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.254 9.2 mtpt -86.68 154.7 20.79 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 112.098 -2.319 . . . . 1.0 112.676 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -71.06 -18.05 62.58 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 117.756 2.502 . . . . 1.0 117.756 -151.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -99.65 -49.93 4.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 119.799 -1.813 . . . . 1.0 111.719 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.6 m -34.0 132.24 0.39 Allowed Pre-proline 0 N--CA 1.439 -1.023 0 C-N-CA 131.286 3.834 . . . . 1.0 118.819 -176.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.404 ' HB2' ' HG2' ' A' ' 42' ' ' LYS . 10.1 Cg_exo -45.34 152.41 0.77 Allowed 'Trans proline' 0 N--CA 1.443 -1.456 2 N-CA-C 125.464 5.14 . . . . 1.0 125.464 -165.989 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -71.18 -25.77 62.68 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 157.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . 0.273 80.9 p -57.67 -29.07 64.32 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.73 -1.856 . . . . 1.0 114.089 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.404 ' HG2' ' HB2' ' A' ' 39' ' ' PRO . 10.4 mmmt -62.16 -42.56 99.38 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.765 1.226 . . . . 1.0 111.075 174.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -42.9 82.82 Favored 'General case' 0 CA--C 1.491 -1.315 0 C-N-CA 127.639 2.376 . . . . 1.0 112.459 176.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.7 ttt -56.84 -43.07 80.75 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -65.74 -41.81 91.71 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.897 -1.127 . . . . 1.0 113.274 172.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.8 -38.71 91.76 Favored 'General case' 0 N--CA 1.435 -1.188 0 C-N-CA 124.68 1.192 . . . . 1.0 113.922 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.403 ' CD1' HG21 ' A' ' 30' ' ' VAL . 3.2 t80 -60.22 -43.2 96.2 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.802 2.041 . . . . 1.0 112.036 171.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.5 m -64.41 -43.05 95.62 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.355 -1.465 . . . . 1.0 114.182 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -65.08 -48.2 74.55 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.468 -1.395 . . . . 1.0 114.283 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -75.33 -43.22 51.86 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 115.505 1.669 . . . . 1.0 115.505 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -114.53 8.36 16.4 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 121.084 -1.01 . . . . 1.0 112.049 -163.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.88 3.43 90.53 Favored Glycine 0 CA--C 1.493 -1.288 0 N-CA-C 117.439 1.735 . . . . 1.0 117.439 159.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.55 155.27 40.23 Favored 'General case' 0 N--CA 1.434 -1.236 0 C-N-CA 125.741 1.616 . . . . 1.0 113.386 -174.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.9 m -102.19 124.93 48.64 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 120.378 -1.451 . . . . 1.0 109.144 175.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.2 ptm -60.95 -29.15 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.019 2.229 . . . . 1.0 117.019 -170.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.99 -15.54 60.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.16 -1.588 . . . . 1.0 114.218 176.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -97.32 -9.61 27.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.564 1.546 . . . . 1.0 112.287 -175.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.0 pt -120.88 143.99 31.27 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 C-N-CA 124.248 1.019 . . . . 1.0 109.597 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -135.92 154.92 50.97 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -113.93 148.54 36.66 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.484 -1.385 . . . . 1.0 109.745 -172.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -137.66 159.41 42.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 123.116 1.436 . . . . 1.0 111.927 177.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -133.25 117.42 17.36 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.177 -1.828 . . . . 1.0 107.992 170.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.7 t70 59.29 31.66 21.34 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 127.312 2.245 . . . . 1.0 113.238 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.48 2.7 88.17 Favored Glycine 0 N--CA 1.435 -1.393 0 O-C-N 119.955 -1.716 . . . . 1.0 114.646 -176.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -102.12 137.06 19.37 Favored Pre-proline 0 N--CA 1.435 -1.214 0 O-C-N 120.161 -1.788 . . . . 1.0 110.076 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -49.09 135.28 30.23 Favored 'Trans proline' 0 N--CA 1.442 -1.553 0 C-N-CA 124.547 3.498 . . . . 1.0 117.832 170.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 pt -121.89 142.49 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 108.244 -1.021 . . . . 1.0 108.244 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -97.65 167.61 10.86 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 121.143 -0.973 . . . . 1.0 110.922 -175.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -67.63 -19.92 65.28 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.444 -1.41 . . . . 1.0 112.684 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.6 m -99.43 2.0 44.69 Favored 'General case' 0 N--CA 1.436 -1.175 0 C-N-CA 126.764 2.026 . . . . 1.0 111.687 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -80.6 169.07 18.13 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 119.028 -2.295 . . . . 1.0 112.24 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.0 p -106.7 153.04 40.94 Favored Pre-proline 0 N--CA 1.438 -1.027 0 O-C-N 120.905 -1.122 . . . . 1.0 113.481 -157.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.05 -31.35 92.82 Favored 'Trans proline' 0 N--CA 1.44 -1.625 0 C-N-CA 123.374 2.716 . . . . 1.0 116.582 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.35 -45.83 78.84 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 114.029 1.122 . . . . 1.0 114.029 174.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.02 -41.3 82.36 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 125.661 1.584 . . . . 1.0 112.622 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 27.7 tp -87.19 -4.03 59.09 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 124.269 1.027 . . . . 1.0 111.601 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 56.85 44.42 23.29 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 126.554 1.942 . . . . 1.0 113.396 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 91.0 mtp -65.98 143.29 57.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.98 2.112 . . . . 1.0 115.148 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -157.56 179.58 9.1 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 105.837 -1.912 . . . . 1.0 105.837 -171.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.409 ' HA ' ' HB ' ' A' ' 18' ' ' ILE 0.3 6.7 p-10 -51.3 -26.52 7.58 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 128.511 2.724 . . . . 1.0 118.239 -178.279 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -137.78 67.45 1.42 Allowed 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 125.106 1.362 . . . . 1.0 110.638 173.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -78.38 162.68 26.26 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 119.342 -2.098 . . . . 1.0 114.409 179.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.6 m -135.39 123.64 23.12 Favored 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.36 1.064 . . . . 1.0 111.053 178.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 78.8 mt -108.0 140.54 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 C-N-CA 126.371 1.869 . . . . 1.0 108.841 174.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -110.97 140.12 45.74 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.612 -1.305 . . . . 1.0 108.562 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.6 t -108.53 139.07 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 O-C-N 120.559 -1.338 . . . . 1.0 109.959 -169.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -124.67 142.63 51.25 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 122.468 1.127 . . . . 1.0 110.059 173.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.7 pm0 -81.84 140.22 34.27 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.065 1.346 . . . . 1.0 111.851 -178.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -138.24 141.96 39.92 Favored 'General case' 0 N--CA 1.434 -1.251 0 O-C-N 120.618 -1.301 . . . . 1.0 109.971 -172.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -107.28 159.33 16.44 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 121.127 -0.983 . . . . 1.0 110.741 -178.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 14.7 t -153.41 153.02 31.72 Favored 'General case' 0 N--CA 1.437 -1.097 0 O-C-N 120.905 -1.122 . . . . 1.0 109.059 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -74.17 -171.95 26.12 Favored Glycine 0 CA--C 1.494 -1.241 0 N-CA-C 116.904 1.522 . . . . 1.0 116.904 -171.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.777 0 O-C-N 121.359 -1.083 . . . . 1.0 111.833 178.833 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.932 0 N-CA-C 115.148 0.819 . . . . 1.0 115.148 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 2.1 p -74.82 -39.96 46.07 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.172 0 CA-C-O 122.801 1.286 . . . . 1.0 111.301 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 3.6 mt -113.13 120.32 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 C-N-CA 125.092 1.357 . . . . 1.0 109.719 162.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.0 140.29 36.49 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 105.032 -2.21 . . . . 1.0 105.032 164.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.85 137.89 44.05 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 122.668 2.485 . . . . 1.0 116.754 -175.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 20.9 p -120.86 8.85 10.56 Favored 'General case' 0 CA--C 1.497 -1.095 0 C-N-CA 126.239 1.816 . . . . 1.0 112.073 -171.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 34.5 mtm -115.91 13.3 15.98 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.617 -1.302 . . . . 1.0 111.558 -173.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -147.66 -25.93 0.37 Allowed 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 115.63 1.715 . . . . 1.0 115.63 -153.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 53.6 -175.7 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 123.69 1.71 . . . . 1.0 114.714 -159.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -60.51 -43.96 96.52 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 127.433 2.293 . . . . 1.0 113.271 178.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 . . . . . 0 N--CA 1.424 -1.748 0 C-N-CA 130.795 3.638 . . . . 1.0 111.292 175.59 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.8 mtt . . . . . 0 N--CA 1.484 1.261 0 N-CA-C 109.773 -0.454 . . . . 1.0 109.773 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.35 -5.98 55.57 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 119.793 -1.817 . . . . 1.0 112.929 173.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -64.98 -46.15 82.66 Favored 'General case' 0 N--CA 1.433 -1.303 0 C-N-CA 126.228 1.811 . . . . 1.0 113.995 177.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -63.74 150.1 45.28 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 128.331 2.652 . . . . 1.0 117.016 -175.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -65.59 150.22 96.34 Favored Pre-proline 0 N--CA 1.433 -1.284 0 C-N-CA 125.827 1.651 . . . . 1.0 112.522 168.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -46.85 139.4 14.29 Favored 'Trans proline' 0 C--N 1.308 -1.592 0 C-N-CA 124.397 3.398 . . . . 1.0 116.457 158.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -129.85 -9.5 4.43 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 124.267 1.027 . . . . 1.0 112.541 -174.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -86.94 147.32 25.81 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 125.133 1.373 . . . . 1.0 111.839 176.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -75.33 -166.05 17.74 Favored Glycine 0 N--CA 1.437 -1.28 0 O-C-N 120.603 -1.311 . . . . 1.0 116.119 173.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.312 2.5 t 62.17 62.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.063 0 C-N-CA 126.252 1.821 . . . . 1.0 115.912 172.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -66.31 151.84 46.23 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.508 -1.37 . . . . 1.0 114.336 173.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 57.7 p -75.91 -11.04 59.89 Favored 'General case' 0 CA--C 1.496 -1.111 0 N-CA-C 116.793 2.145 . . . . 1.0 116.793 -166.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -66.47 -35.64 80.78 Favored 'General case' 0 N--CA 1.438 -1.074 0 O-C-N 120.737 -1.227 . . . . 1.0 111.771 169.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.3 t30 71.72 41.06 0.73 Allowed 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 127.164 2.186 . . . . 1.0 112.976 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -130.87 141.16 50.29 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 122.371 1.081 . . . . 1.0 110.063 -174.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.91 10.66 22.97 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 125.398 1.479 . . . . 1.0 113.872 -173.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -78.19 126.18 30.43 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 116.005 1.854 . . . . 1.0 116.005 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.9 pt -143.04 160.75 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 C-N-CA 128.368 2.667 . . . . 1.0 107.545 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -117.66 144.85 44.83 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.143 -2.223 . . . . 1.0 108.422 174.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -127.19 150.56 49.47 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 119.835 -1.791 . . . . 1.0 107.541 173.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -115.31 148.94 38.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 119.667 -1.895 . . . . 1.0 110.883 171.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.4 t -119.45 123.52 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.54 -1.652 . . . . 1.0 106.54 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.03 130.1 53.64 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.639 1.209 . . . . 1.0 112.188 -173.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -88.78 -179.69 46.03 Favored Glycine 0 N--CA 1.432 -1.572 0 CA-C-O 122.928 1.293 . . . . 1.0 113.561 177.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -91.9 2.79 56.3 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 121.302 -1.116 . . . . 1.0 112.967 -175.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -97.55 5.66 49.22 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 126.004 1.722 . . . . 1.0 111.373 169.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.17 5.65 89.93 Favored Glycine 0 CA--C 1.494 -1.267 0 O-C-N 120.092 -1.63 . . . . 1.0 114.542 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.6 m -88.7 139.31 30.59 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 124.382 1.073 . . . . 1.0 110.292 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 p -139.88 140.63 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 O-C-N 121.569 -0.707 . . . . 1.0 109.942 -169.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.265 0.6 OUTLIER -129.15 138.76 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 O-C-N 119.888 -1.757 . . . . 1.0 110.571 166.477 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.13 149.21 41.43 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-O 124.199 1.952 . . . . 1.0 113.807 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.44 140.71 37.41 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.724 -1.86 . . . . 1.0 107.771 -162.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.435 ' HZ3' ' CG ' ' B' ' 968' ' ' ASP . 12.5 ttpt -103.88 115.87 31.24 Favored 'General case' 0 CA--C 1.493 -1.232 0 C-N-CA 126.304 1.842 . . . . 1.0 111.697 -175.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 11.0 tt -143.04 154.77 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.388 0 CA-C-O 124.917 2.294 . . . . 1.0 109.943 -152.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -115.03 153.6 30.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 111.716 -2.493 . . . . 1.0 110.26 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.01 -38.08 89.74 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 115.916 1.821 . . . . 1.0 115.916 -158.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -87.06 10.01 17.91 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.916 -1.115 . . . . 1.0 113.945 175.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.4 m -91.8 121.77 66.53 Favored Pre-proline 0 N--CA 1.437 -1.105 0 O-C-N 119.409 -2.057 . . . . 1.0 108.265 177.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.08 158.2 49.19 Favored 'Trans proline' 0 N--CA 1.441 -1.617 0 C-N-CA 123.13 2.554 . . . . 1.0 115.569 -175.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.448 1.5 pp -63.23 -25.66 68.43 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 115.183 1.549 . . . . 1.0 115.183 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.6 p -52.68 -29.06 24.49 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 120.37 -1.456 . . . . 1.0 114.469 170.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.24 -43.13 71.21 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 119.819 -1.801 . . . . 1.0 112.923 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.09 69.7 Favored 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 120.452 -1.405 . . . . 1.0 113.376 172.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.51 -43.53 98.7 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.433 -1.417 . . . . 1.0 113.289 174.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -42.57 98.6 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.686 -1.259 . . . . 1.0 113.596 170.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.23 86.76 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.21 -43.74 95.71 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 126.005 1.722 . . . . 1.0 111.695 175.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.5 m -62.5 -42.58 99.59 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.86 1.264 . . . . 1.0 114.077 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -64.57 -46.22 83.69 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 120.206 -1.558 . . . . 1.0 114.382 174.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -78.38 -43.2 28.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 116.078 1.881 . . . . 1.0 116.078 -178.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.0 mm100 -113.64 4.98 16.31 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 121.509 -0.744 . . . . 1.0 111.84 -166.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.38 84.1 Favored Glycine 0 CA--C 1.494 -1.251 0 N-CA-C 118.655 2.222 . . . . 1.0 118.655 161.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.5 mt -85.02 164.67 18.11 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 121.187 -1.184 . . . . 1.0 113.841 -172.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.9 m -102.2 135.68 43.37 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.394 -1.441 . . . . 1.0 110.709 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.2 mtp -61.82 -38.71 89.18 Favored 'General case' 0 CA--C 1.495 -1.153 0 C-N-CA 125.887 1.675 . . . . 1.0 114.308 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 ptt-85 -92.67 0.73 57.47 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 125.098 1.359 . . . . 1.0 112.751 -175.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mm-40 -92.73 -24.52 18.56 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.61 -1.306 . . . . 1.0 111.002 175.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.1 pt -120.35 149.34 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 O-C-N 120.972 -1.08 . . . . 1.0 110.82 -174.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -134.41 154.97 51.09 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 107.872 -1.159 . . . . 1.0 107.872 168.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -106.51 148.6 28.02 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 -175.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -142.26 155.36 45.23 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 114.834 1.42 . . . . 1.0 114.834 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -115.19 107.45 15.31 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 106.948 -1.501 . . . . 1.0 106.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.2 t70 52.71 33.32 13.66 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 114.84 1.422 . . . . 1.0 114.84 175.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.49 5.78 89.16 Favored Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 118.755 2.262 . . . . 1.0 118.755 -177.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -123.63 152.83 66.0 Favored Pre-proline 0 N--CA 1.436 -1.145 0 CA-C-O 111.748 -3.977 . . . . 1.0 103.887 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.786 57.9 Cg_exo 71.97 155.76 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.827 2 C-N-CA 111.555 -5.163 . . . . 1.0 116.871 169.535 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.295 5.9 pt -123.91 159.24 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 1 C-N-CA 135.01 5.324 . . . . 1.0 111.136 17.769 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -102.82 163.02 12.46 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 120.816 1.644 . . . . 1.0 110.62 172.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.98 -34.63 75.08 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 119.102 -2.248 . . . . 1.0 115.257 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.4 m -92.03 8.53 37.28 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.5 1.12 . . . . 1.0 111.882 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -81.8 172.74 13.0 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.302 -2.124 . . . . 1.0 108.88 163.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 47.7 p -147.03 159.69 42.17 Favored Pre-proline 0 CA--C 1.498 -1.056 0 O-C-N 119.186 -2.196 . . . . 1.0 111.985 -163.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -59.4 -32.17 96.07 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.602 2.868 . . . . 1.0 115.674 168.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.38 -46.08 81.52 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 119.293 0.951 . . . . 1.0 113.154 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -69.22 -41.39 77.1 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 125.507 1.523 . . . . 1.0 113.605 -177.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -79.94 -8.41 59.31 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.661 -1.275 . . . . 1.0 112.805 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.12 46.87 7.72 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 126.124 1.77 . . . . 1.0 113.753 -178.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.0 mtt -62.26 153.78 29.64 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 126.767 2.027 . . . . 1.0 114.047 173.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.59 -179.9 3.93 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.172 0.989 . . . . 1.0 109.277 -171.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -57.3 -26.6 61.13 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 127.155 2.182 . . . . 1.0 116.007 -175.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -136.54 91.37 2.65 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 107.785 -1.191 . . . . 1.0 107.785 161.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.42 161.43 19.43 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.97 -1.706 . . . . 1.0 112.418 173.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.3 m -130.17 115.3 16.82 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 122.224 1.012 . . . . 1.0 110.742 -177.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 140.68 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 126.841 2.056 . . . . 1.0 108.363 -172.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -110.97 151.35 28.04 Favored 'General case' 0 N--CA 1.433 -1.279 0 O-C-N 120.008 -1.682 . . . . 1.0 110.272 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.0 t -108.66 139.56 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 O-C-N 121.026 -1.046 . . . . 1.0 110.29 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -132.43 139.78 48.16 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-O 122.102 0.953 . . . . 1.0 110.036 165.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -87.85 141.21 28.77 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 124.476 1.11 . . . . 1.0 111.482 -175.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -101.0 -141.66 0.34 Allowed 'General case' 0 N--CA 1.434 -1.242 0 C-N-CA 124.641 1.176 . . . . 1.0 113.101 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -65.36 114.01 4.49 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 115.225 1.565 . . . . 1.0 115.225 -174.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 60.4 p -80.5 154.03 27.8 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.616 -1.302 . . . . 1.0 112.683 175.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.94 27.44 28.76 Favored Glycine 0 CA--C 1.493 -1.307 0 O-C-N 120.903 -1.123 . . . . 1.0 113.832 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.71 0 O-C-N 121.346 -1.091 . . . . 1.0 111.314 -178.625 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.925 0 N-CA-C 115.12 0.808 . . . . 1.0 115.12 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER -74.87 -48.28 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 N-CA-C 114.728 1.381 . . . . 1.0 114.728 -168.741 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -107.82 120.13 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.21 0 N-CA-C 107.094 -1.447 . . . . 1.0 107.094 -172.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . 0.435 ' CG ' ' HZ3' ' A' ' 33' ' ' LYS . 10.9 t0 -102.17 116.9 33.63 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.204 -1.56 . . . . 1.0 107.14 164.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.11 149.82 28.0 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 120.346 1.43 . . . . 1.0 114.851 -175.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 11.0 t -123.05 136.93 55.03 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 124.777 1.231 . . . . 1.0 110.14 175.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 21.2 ttt -155.66 24.07 0.39 Allowed 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.593 1.557 . . . . 1.0 106.889 172.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . 0.408 ' CG ' ' H ' ' B' ' 973' ' ' ASP . 4.9 p-10 -144.95 -94.07 0.1 Allowed 'General case' 0 N--CA 1.433 -1.316 0 O-C-N 120.591 -1.318 . . . . 1.0 110.09 -157.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . 0.408 ' H ' ' CG ' ' B' ' 972' ' ' ASP . 32.0 t70 -153.04 26.51 0.54 Allowed 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 125.143 1.377 . . . . 1.0 108.543 -179.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.19 44.07 2.66 Favored 'General case' 0 N--CA 1.435 -1.219 0 C-N-CA 127.09 2.156 . . . . 1.0 115.846 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 . . . . . 0 C--O 1.262 1.727 0 C-N-CA 124.193 0.997 . . . . 1.0 113.626 171.998 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 tpt . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 110.366 -0.235 . . . . 1.0 110.366 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.16 -15.37 60.58 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 119.38 -2.075 . . . . 1.0 113.408 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.15 2.32 56.66 Favored 'General case' 0 N--CA 1.432 -1.328 0 C-N-CA 128.118 2.567 . . . . 1.0 113.621 -174.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 57.03 170.3 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 117.684 2.476 . . . . 1.0 117.684 -176.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.8 mppt? -65.88 153.91 90.33 Favored Pre-proline 0 N--CA 1.435 -1.215 0 C-N-CA 126.299 1.839 . . . . 1.0 112.389 -179.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_exo -44.34 131.93 9.24 Favored 'Trans proline' 0 N--CA 1.442 -1.513 0 C-N-CA 124.793 3.662 . . . . 1.0 117.093 173.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -66.57 131.11 45.31 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 113.904 1.076 . . . . 1.0 113.904 -174.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -79.38 -52.61 7.86 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 120.933 -1.104 . . . . 1.0 112.9 -171.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 59.74 29.09 66.6 Favored Glycine 0 N--CA 1.436 -1.339 0 N-CA-C 119.065 2.386 . . . . 1.0 119.065 165.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.1 p -119.07 138.92 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-N 119.78 1.79 . . . . 1.0 110.058 -176.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -58.92 140.69 55.18 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 120.188 -1.57 . . . . 1.0 113.926 171.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.3 p -115.1 -1.24 13.07 Favored 'General case' 0 N--CA 1.436 -1.128 0 O-C-N 120.704 -1.247 . . . . 1.0 111.761 -176.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 58.56 52.68 6.75 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 115.917 1.821 . . . . 1.0 115.917 170.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.6 m120 -114.42 13.8 17.76 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.597 -1.315 . . . . 1.0 113.354 -171.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 56.98 55.45 6.1 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 125.472 1.509 . . . . 1.0 114.377 178.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -96.67 2.15 51.81 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 117.049 2.24 . . . . 1.0 117.049 -153.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -61.1 138.98 58.19 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.7 pt -135.25 160.65 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 131.213 3.805 . . . . 1.0 106.847 -175.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -113.86 144.9 42.26 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 118.818 -2.426 . . . . 1.0 110.832 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.33 157.62 46.36 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.476 -2.64 . . . . 1.0 105.687 175.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -119.99 150.66 40.17 Favored 'General case' 0 N--CA 1.434 -1.226 0 C-N-CA 127.32 2.248 . . . . 1.0 112.654 171.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.83 132.37 54.32 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.188 0 N-CA-C 106.242 -1.762 . . . . 1.0 106.242 169.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.66 130.15 56.18 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 121.467 0.651 . . . . 1.0 109.479 169.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.49 -179.78 34.98 Favored Glycine 0 N--CA 1.435 -1.372 0 C-N-CA 124.774 1.178 . . . . 1.0 114.69 -176.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -62.58 -38.69 91.11 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 126.565 1.946 . . . . 1.0 114.028 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -75.76 -13.47 60.3 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.348 -1.47 . . . . 1.0 111.905 -178.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.75 1.31 55.22 Favored Glycine 0 N--CA 1.435 -1.406 0 C-N-CA 125.643 1.592 . . . . 1.0 112.899 -176.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.8 m -70.23 146.45 50.67 Favored 'General case' 0 N--CA 1.435 -1.214 0 C-N-CA 125.1 1.36 . . . . 1.0 112.123 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.85 134.86 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 C-N-CA 123.918 0.887 . . . . 1.0 111.398 -172.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.474 ' CG1' ' CE1' ' A' ' 32' ' ' PHE . 0.6 OUTLIER -129.14 138.71 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.243 -1.536 . . . . 1.0 107.852 168.279 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.485 ' H ' HG22 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -114.8 158.06 22.4 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 126.538 3.066 . . . . 1.0 113.49 172.504 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.474 ' CE1' ' CG1' ' A' ' 30' ' ' VAL 0.271 25.6 m-85 -145.11 148.23 33.41 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 118.218 -2.801 . . . . 1.0 109.214 -159.575 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -116.51 115.7 26.26 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 120.496 1.498 . . . . 1.0 112.965 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.465 ' CG1' ' H ' ' A' ' 35' ' ' LYS . 20.9 tt -150.9 154.75 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 125.665 2.65 . . . . 1.0 111.538 -164.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.488 ' HZ3' ' C ' ' B' ' 975' ' ' GLU . 0.0 OUTLIER -93.69 163.01 13.71 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 110.983 -2.826 . . . . 1.0 111.731 -172.956 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -69.94 -37.11 75.78 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 117.582 2.438 . . . . 1.0 117.582 -162.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -88.44 -24.32 23.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.401 -1.437 . . . . 1.0 113.174 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m -60.68 137.08 92.94 Favored Pre-proline 0 N--CA 1.438 -1.073 0 C-N-CA 126.544 1.938 . . . . 1.0 114.037 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -76.54 157.2 36.38 Favored 'Trans proline' 0 N--CA 1.441 -1.568 0 CA-C-N 123.76 2.378 . . . . 1.0 115.235 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.319 1.4 pp -62.84 -25.71 68.4 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 125.341 1.456 . . . . 1.0 114.643 179.055 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.0 t -52.8 -29.08 25.57 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.663 -1.898 . . . . 1.0 115.216 170.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -45.58 66.57 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.01 -1.681 . . . . 1.0 111.039 -170.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.468 ' HB2' ' CD1' ' A' ' 32' ' ' PHE 0.332 0.0 OUTLIER -65.81 -36.5 83.67 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 115.151 1.537 . . . . 1.0 115.151 171.465 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.1 tpp -62.27 -40.66 96.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 114.738 1.385 . . . . 1.0 114.738 177.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -65.7 -41.11 92.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 O-C-N 120.054 -1.654 . . . . 1.0 112.793 171.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.89 -37.14 83.48 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.697 -1.252 . . . . 1.0 114.078 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.39 -44.94 89.16 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.189 -1.569 . . . . 1.0 112.427 171.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.6 m -61.75 -39.96 93.45 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 124.126 0.97 . . . . 1.0 113.184 175.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -66.29 -47.82 72.37 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.5 1.12 . . . . 1.0 113.86 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -69.03 -43.32 74.96 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.383 -1.448 . . . . 1.0 114.621 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.2 mm100 -114.19 8.47 16.87 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 114.302 1.223 . . . . 1.0 114.302 -163.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.03 42.23 12.68 Favored Glycine 0 CA--C 1.494 -1.264 0 N-CA-C 116.355 1.302 . . . . 1.0 116.355 163.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 30.5 mt -116.63 162.87 16.97 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 121.176 -1.191 . . . . 1.0 110.165 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 55.0 m -102.36 132.55 48.27 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.535 -1.353 . . . . 1.0 110.019 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.8 tpt -61.78 -40.67 96.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 126.145 1.778 . . . . 1.0 114.229 -166.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -97.62 13.21 30.93 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.708 -1.245 . . . . 1.0 112.131 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -105.93 -7.51 18.14 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 124.22 1.008 . . . . 1.0 111.34 171.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.4 pt -111.76 136.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 O-C-N 121.095 -1.003 . . . . 1.0 110.015 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.1 mmt180 -123.79 139.03 54.38 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.709 -1.244 . . . . 1.0 109.54 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.27 143.94 48.05 Favored 'General case' 0 N--CA 1.433 -1.323 0 O-C-N 120.675 -1.266 . . . . 1.0 111.48 -162.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -141.11 154.79 46.08 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 124.508 1.123 . . . . 1.0 110.445 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -133.62 117.92 17.61 Favored 'General case' 0 N--CA 1.433 -1.305 0 O-C-N 120.626 -1.296 . . . . 1.0 108.351 176.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 44.2 t0 51.62 45.05 28.7 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.117 1.767 . . . . 1.0 112.713 -175.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.2 0.96 72.78 Favored Glycine 0 N--CA 1.436 -1.349 0 N-CA-C 116.58 1.392 . . . . 1.0 116.58 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -112.64 128.92 24.94 Favored Pre-proline 0 N--CA 1.436 -1.125 0 O-C-N 120.027 -1.867 . . . . 1.0 110.728 -174.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -48.53 136.19 26.56 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 124.686 3.591 . . . . 1.0 117.952 170.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 4.3 pt -123.19 154.18 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.183 0 C-N-CA 125.36 1.464 . . . . 1.0 109.349 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -110.49 161.2 15.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 121.036 -1.04 . . . . 1.0 109.049 -171.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -65.88 -25.6 67.25 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 119.536 -1.978 . . . . 1.0 113.243 173.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 m -78.42 -18.4 55.03 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.531 1.932 . . . . 1.0 112.947 173.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -67.52 160.26 28.01 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-O 124.189 1.947 . . . . 1.0 112.495 174.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.3 p -144.31 162.22 40.85 Favored Pre-proline 0 CA--C 1.496 -1.133 0 CA-C-N 114.472 -1.24 . . . . 1.0 110.025 -158.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -60.56 -32.44 93.5 Favored 'Trans proline' 0 N--CA 1.439 -1.698 0 C-N-CA 123.2 2.6 . . . . 1.0 114.558 168.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.22 -45.73 83.52 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 122.264 1.03 . . . . 1.0 113.155 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -71.22 -44.36 65.53 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 124.735 1.214 . . . . 1.0 113.2 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -87.75 -8.35 56.14 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 113.568 0.951 . . . . 1.0 113.568 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.29 42.24 15.29 Favored 'General case' 0 N--CA 1.435 -1.214 0 C-N-CA 128.664 2.786 . . . . 1.0 115.901 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtm -69.61 154.24 42.29 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 126.861 2.065 . . . . 1.0 113.832 169.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -141.02 -175.09 4.18 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 105.919 -1.882 . . . . 1.0 105.919 -164.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.337 4.0 p-10 -50.45 -26.47 5.11 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 118.875 2.917 . . . . 1.0 118.875 -167.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -141.48 58.54 1.51 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.34 1.056 . . . . 1.0 113.062 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 169.35 16.87 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 119.005 -2.31 . . . . 1.0 116.821 -173.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.3 m -131.87 122.12 25.17 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 124.998 1.319 . . . . 1.0 112.182 -176.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 52.8 mt -112.91 140.73 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.061 0 C-N-CA 127.65 2.38 . . . . 1.0 108.132 175.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -110.95 134.28 52.7 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 120.66 -1.275 . . . . 1.0 108.615 -177.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.69 132.96 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 C-N-CA 125.328 1.451 . . . . 1.0 107.139 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -130.52 134.23 46.88 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.732 1.253 . . . . 1.0 110.956 177.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -88.05 140.25 29.68 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 124.988 1.315 . . . . 1.0 112.968 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -116.16 -168.02 1.37 Allowed 'General case' 0 N--CA 1.434 -1.238 0 C-N-CA 126.017 1.727 . . . . 1.0 112.162 -172.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.8 mp0 -62.49 146.53 51.4 Favored 'General case' 0 N--CA 1.436 -1.173 0 C-N-CA 125.779 1.632 . . . . 1.0 114.281 177.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 77.2 p -71.17 -42.97 68.38 Favored 'General case' 0 CA--C 1.496 -1.121 0 O-C-N 120.807 -1.183 . . . . 1.0 113.676 176.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.76 151.85 52.44 Favored Glycine 0 CA--C 1.493 -1.331 0 O-C-N 120.493 -1.379 . . . . 1.0 114.614 176.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.712 0 N-CA-C 109.671 -1.372 . . . . 1.0 109.671 -177.833 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.938 0 CA-C-O 120.146 -0.252 . . . . 1.0 113.114 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . 0.485 HG22 ' H ' ' A' ' 31' ' ' GLN . 2.2 t -77.31 -125.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 CA-C-N 118.771 1.285 . . . . 1.0 113.391 173.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -109.56 125.19 66.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 O-C-N 118.962 -2.337 . . . . 1.0 112.763 -146.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -99.37 125.05 44.98 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.12 2.168 . . . . 1.0 110.382 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -108.13 145.65 33.82 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 116.165 1.913 . . . . 1.0 116.165 -173.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 72.6 p -130.97 -144.69 0.26 Allowed 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 126.642 1.977 . . . . 1.0 108.785 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.364 21.0 ttp 88.46 29.96 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 126.895 2.078 . . . . 1.0 115.678 167.267 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -137.49 -82.3 0.35 Allowed 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 104.27 -2.493 . . . . 1.0 104.27 167.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -110.93 177.6 4.61 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 102.704 -3.073 . . . . 1.0 102.704 147.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -65.54 -52.09 55.06 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 120.732 -1.23 . . . . 1.0 111.859 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . 0.488 ' C ' ' HZ3' ' A' ' 35' ' ' LYS 0.293 30.9 tt0 . . . . . 0 C--O 1.259 1.563 0 N-CA-C 116.221 1.934 . . . . 1.0 116.221 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.7 mmm . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 111.399 0.148 . . . . 1.0 111.399 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.67 -41.12 96.31 Favored 'General case' 0 N--CA 1.435 -1.204 0 N-CA-C 115.94 1.829 . . . . 1.0 115.94 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -61.26 -37.26 82.48 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 116.791 2.145 . . . . 1.0 116.791 -168.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -54.99 137.04 47.06 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 115.813 1.782 . . . . 1.0 115.813 -177.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -93.75 158.87 35.81 Favored Pre-proline 0 N--CA 1.434 -1.253 0 C-N-CA 126.509 1.924 . . . . 1.0 111.33 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -43.75 149.65 0.67 Allowed 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 124.639 3.559 . . . . 1.0 117.101 163.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.0 pttm -128.05 -7.19 5.45 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 118.973 0.806 . . . . 1.0 112.069 178.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -117.2 132.05 56.73 Favored 'General case' 0 N--CA 1.434 -1.253 0 O-C-N 120.567 -1.333 . . . . 1.0 111.009 -172.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 80.07 13.51 81.95 Favored Glycine 0 N--CA 1.437 -1.252 0 O-C-N 120.523 -1.36 . . . . 1.0 114.393 -171.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -96.0 138.31 21.78 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.127 0 O-C-N 120.756 -1.438 . . . . 1.0 110.717 -170.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -125.16 148.25 48.67 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.758 -1.214 . . . . 1.0 108.834 169.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.9 t -156.01 -6.28 0.12 Allowed 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 116.074 1.879 . . . . 1.0 116.074 173.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -125.13 -35.53 2.63 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.148 -1.595 . . . . 1.0 111.014 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -142.12 158.68 43.47 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 120.765 -1.209 . . . . 1.0 110.215 -177.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -45.31 158.35 0.07 Allowed 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 117.702 2.482 . . . . 1.0 117.702 173.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -96.81 39.89 1.16 Allowed 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 124.85 1.26 . . . . 1.0 114.367 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -71.85 139.98 49.14 Favored 'General case' 0 CA--C 1.497 -1.058 0 O-C-N 119.065 -2.272 . . . . 1.0 115.85 176.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.6 pt -140.35 160.76 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 128.568 2.747 . . . . 1.0 105.832 175.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -109.44 144.75 37.24 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 118.838 -2.414 . . . . 1.0 107.995 168.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -137.38 147.76 45.72 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.613 -1.93 . . . . 1.0 106.988 175.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -116.83 150.59 38.12 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 125.6 1.56 . . . . 1.0 113.022 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.9 t -111.78 125.98 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.206 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 170.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.34 134.48 54.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 122.406 1.098 . . . . 1.0 112.593 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.7 -156.85 19.92 Favored Glycine 0 CA--C 1.492 -1.398 0 O-C-N 120.744 -1.222 . . . . 1.0 111.319 177.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 55.11 40.45 31.85 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 116.638 2.088 . . . . 1.0 116.638 164.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 t70 66.96 43.09 2.28 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 126.255 1.822 . . . . 1.0 112.784 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.51 24.82 25.08 Favored Glycine 0 N--CA 1.436 -1.309 0 O-C-N 120.798 -1.189 . . . . 1.0 115.213 174.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -101.26 127.95 47.62 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-O 122.669 1.223 . . . . 1.0 110.064 173.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.4 t -139.87 137.63 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 O-C-N 120.669 -1.27 . . . . 1.0 109.195 -166.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.18 138.73 53.69 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 O-C-N 120.236 -1.54 . . . . 1.0 110.383 169.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.12 145.05 50.12 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 123.183 1.468 . . . . 1.0 112.696 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . 0.342 0.5 OUTLIER -144.41 140.61 29.11 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.118 -1.614 . . . . 1.0 108.627 -158.274 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.323 35.6 ttpt -110.96 115.5 29.59 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 123.428 1.585 . . . . 1.0 112.037 -170.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.554 ' CD1' ' H ' ' A' ' 35' ' ' LYS . 4.6 tp -154.81 154.83 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 127.498 3.523 . . . . 1.0 112.624 -163.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.554 ' H ' ' CD1' ' A' ' 34' ' ' ILE . 11.4 mptt -64.12 142.88 58.25 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 109.414 -3.539 . . . . 1.0 113.685 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.9 ttt-85 -71.2 -28.48 64.25 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.168 -1.378 . . . . 1.0 113.516 -173.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -76.21 -29.84 57.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 115.648 1.721 . . . . 1.0 115.648 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 75.0 m -62.49 141.26 96.68 Favored Pre-proline 0 N--CA 1.439 -1.004 0 C-N-CA 127.425 2.29 . . . . 1.0 114.288 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -56.27 145.93 74.89 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 123.957 3.104 . . . . 1.0 116.797 174.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.291 1.3 pt? -63.74 -25.61 68.27 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 114.498 1.296 . . . . 1.0 114.498 172.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.8 t -52.64 -29.13 24.58 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 125.787 1.635 . . . . 1.0 114.62 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -65.77 -42.47 90.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.314 -2.116 . . . . 1.0 112.553 176.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.87 -41.58 99.44 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 126.441 1.896 . . . . 1.0 114.463 171.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 77.0 mtp -57.31 -45.9 83.75 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 113.578 0.955 . . . . 1.0 113.578 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -66.35 -40.2 89.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.456 -1.403 . . . . 1.0 113.044 173.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.34 83.41 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.563 -1.336 . . . . 1.0 114.054 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -61.58 -42.28 98.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 O-C-N 120.21 -1.556 . . . . 1.0 110.83 172.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.8 m -61.35 -46.34 90.65 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.135 1.532 . . . . 1.0 115.135 173.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -69.55 -49.85 50.47 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 115.873 1.805 . . . . 1.0 115.873 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -70.63 -38.18 73.88 Favored 'General case' 0 CA--C 1.493 -1.236 0 C-N-CA 125.632 1.573 . . . . 1.0 113.877 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.96 10.95 20.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 O-C-N 121.509 -0.745 . . . . 1.0 111.676 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.81 44.75 24.06 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.756 1.462 . . . . 1.0 116.756 161.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.2 mt -121.66 154.47 36.79 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 121.469 -1.019 . . . . 1.0 110.957 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.0 m -100.14 136.27 40.29 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 120.514 -1.366 . . . . 1.0 109.923 174.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.4 tpt -59.55 -35.05 73.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.86 2.064 . . . . 1.0 114.055 -176.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.445 ' H ' ' HG2' ' A' ' 56' ' ' ARG . 20.2 ptt-85 -90.0 4.15 51.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.203 1.801 . . . . 1.0 111.151 -174.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.02 -14.49 16.44 Favored 'General case' 0 N--CA 1.432 -1.367 0 O-C-N 121.024 -1.047 . . . . 1.0 111.854 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.6 pt -127.76 159.97 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 119.897 1.226 . . . . 1.0 112.282 -166.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -138.31 147.71 43.85 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.201 -1.037 . . . . 1.0 108.201 169.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -104.6 144.57 31.52 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 126.455 1.902 . . . . 1.0 107.438 -172.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.661 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 7.5 tmm_? -152.19 144.81 24.21 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 -167.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.661 ' CG ' ' HA ' ' A' ' 61' ' ' ARG 0.804 0.0 OUTLIER -123.1 142.63 50.67 Favored 'General case' 0 N--CA 1.408 -2.566 1 N-CA-C 94.606 -6.072 . . . . 1.0 94.606 -122.145 . . . . . . . . 5 4 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -69.83 74.68 0.44 Allowed 'General case' 0 N--CA 1.438 -1.038 0 O-C-N 119.747 -1.845 . . . . 1.0 115.434 -159.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.42 3.93 78.73 Favored Glycine 0 N--CA 1.433 -1.518 0 C-N-CA 127.639 2.542 . . . . 1.0 112.251 -159.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.602 ' O ' ' CB ' ' A' ' 62' ' ' PHE . 53.4 mt-30 -123.75 153.22 66.77 Favored Pre-proline 0 N--CA 1.428 -1.532 1 N-CA-C 99.719 -4.178 . . . . 1.0 99.719 -158.3 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.534 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 55.5 Cg_endo -72.12 135.97 26.1 Favored 'Trans proline' 0 N--CA 1.444 -1.406 1 C-N-CA 125.457 4.105 . . . . 1.0 116.295 148.22 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.554 HG12 ' HB3' ' A' ' 62' ' ' PHE . 5.8 pt -117.59 127.24 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.117 0 C-N-CA 126.897 2.079 . . . . 1.0 108.976 171.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -112.8 158.75 19.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 125.381 1.473 . . . . 1.0 108.772 175.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -59.99 -25.32 65.15 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 118.9 -2.375 . . . . 1.0 116.947 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 m -92.35 -2.27 56.49 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.622 -1.299 . . . . 1.0 111.351 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -73.18 171.81 12.28 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 119.311 -2.118 . . . . 1.0 111.988 172.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 64.9 p -146.34 154.41 49.37 Favored Pre-proline 0 CA--C 1.495 -1.141 0 O-C-N 120.097 -1.627 . . . . 1.0 109.415 -162.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -58.16 -31.64 93.8 Favored 'Trans proline' 0 N--CA 1.44 -1.672 0 C-N-CA 123.272 2.648 . . . . 1.0 116.078 170.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.09 89.99 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -74.35 -41.11 61.59 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.966 1.306 . . . . 1.0 113.306 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.78 -8.49 59.7 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 122.124 0.964 . . . . 1.0 112.665 178.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.289 42.2 mm-40 64.43 48.16 2.82 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 126.204 1.802 . . . . 1.0 114.416 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.2 mtt -82.05 154.25 25.72 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 127.03 2.132 . . . . 1.0 111.06 172.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -125.89 -178.98 4.47 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 121.062 -1.024 . . . . 1.0 109.396 -164.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.376 9.1 p-10 -54.1 -26.55 27.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 117.217 2.303 . . . . 1.0 117.217 -174.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -135.75 89.49 2.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 123.277 0.631 . . . . 1.0 111.366 158.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.7 170.53 10.06 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 116.765 2.135 . . . . 1.0 116.765 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.9 m -135.87 120.95 18.84 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 125.008 1.323 . . . . 1.0 112.473 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.8 mt -110.22 140.78 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.106 0 C-N-CA 129.972 3.309 . . . . 1.0 108.31 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -110.82 146.43 36.43 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.939 -1.726 . . . . 1.0 108.693 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.4 t -121.18 139.69 47.59 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.218 0 O-C-N 121.17 -0.956 . . . . 1.0 108.969 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -128.58 143.24 50.92 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 121.367 -0.833 . . . . 1.0 111.14 163.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -87.16 130.27 34.6 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.739 1.257 . . . . 1.0 112.76 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -102.07 -22.69 14.19 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 125.169 1.387 . . . . 1.0 111.147 -179.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . 0.318 22.0 pt20 50.94 40.29 24.85 Favored 'General case' 0 N--CA 1.436 -1.13 0 C-N-CA 128.954 2.901 . . . . 1.0 117.853 173.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 21.0 p -81.42 -47.07 13.7 Favored 'General case' 0 N--CA 1.436 -1.133 0 O-C-N 120.264 -1.522 . . . . 1.0 112.799 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -86.93 -176.83 49.23 Favored Glycine 0 N--CA 1.436 -1.328 0 O-C-N 120.737 -1.227 . . . . 1.0 112.006 169.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.742 0 O-C-N 121.463 -1.022 . . . . 1.0 110.606 175.338 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.951 0 N-CA-C 114.784 0.674 . . . . 1.0 114.784 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 16.5 t -74.92 -57.91 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.134 0 CA-C-O 123.978 1.847 . . . . 1.0 114.012 -171.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 6.5 mt -113.05 111.01 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 C-N-CA 127.127 2.171 . . . . 1.0 110.808 -171.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -102.18 109.08 20.67 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 119.172 -2.205 . . . . 1.0 112.703 171.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . 0.402 HD22 ' HB ' ' A' ' 34' ' ' ILE 0.275 0.4 OUTLIER -102.83 156.05 17.92 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 122.713 2.506 . . . . 1.0 114.433 -172.101 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 69.1 p -111.92 17.11 20.02 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 126.1 1.76 . . . . 1.0 111.316 -170.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 22.7 ttt -57.88 -33.94 69.25 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 116.37 1.989 . . . . 1.0 116.37 -174.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -144.36 145.08 31.75 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 120.88 -1.138 . . . . 1.0 109.817 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 1.1 t70 52.84 -143.96 0.67 Allowed 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 115.595 1.702 . . . . 1.0 115.595 162.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -87.51 132.7 33.94 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 128.131 2.573 . . . . 1.0 109.344 176.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 . . . . . 0 C--O 1.261 1.709 0 N-CA-C 116.667 2.099 . . . . 1.0 116.667 -165.737 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.8 mtp . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 112.308 0.484 . . . . 1.0 112.308 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.18 -42.87 83.51 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.857 -1.152 . . . . 1.0 113.667 178.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.409 ' CG ' ' HZ3' ' A' ' 5' ' ' LYS . 37.2 t70 -128.88 119.09 23.81 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 126.03 1.732 . . . . 1.0 107.733 177.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -98.87 -12.74 20.49 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.23 -1.544 . . . . 1.0 113.262 -169.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.409 ' HZ3' ' CG ' ' A' ' 3' ' ' ASP . 25.5 pttm -64.65 137.99 97.31 Favored Pre-proline 0 N--CA 1.436 -1.163 0 O-C-N 120.318 -1.489 . . . . 1.0 114.445 -178.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.27 142.63 19.19 Favored 'Trans proline' 0 N--CA 1.442 -1.546 0 C-N-CA 122.651 2.234 . . . . 1.0 113.037 -164.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -106.82 -2.2 21.68 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 124.156 0.983 . . . . 1.0 111.604 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -59.9 152.53 23.22 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 117.458 2.392 . . . . 1.0 117.458 178.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -85.28 179.6 50.71 Favored Glycine 0 N--CA 1.437 -1.259 0 O-C-N 120.848 -1.158 . . . . 1.0 111.898 161.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.3 p -68.87 142.29 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.105 0 O-C-N 120.705 -1.468 . . . . 1.0 113.991 -178.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -111.67 6.45 19.9 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.716 -1.865 . . . . 1.0 112.454 -174.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 62.5 p -112.82 145.29 40.9 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 120.602 -1.311 . . . . 1.0 111.149 -175.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -63.08 -45.9 89.97 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 124.309 1.044 . . . . 1.0 113.362 -175.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -148.87 147.12 28.34 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 107.454 -1.313 . . . . 1.0 107.454 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -64.39 145.47 56.0 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 115.206 1.558 . . . . 1.0 115.206 -173.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -105.49 13.87 29.48 Favored 'General case' 0 N--CA 1.436 -1.148 0 C-N-CA 126.439 1.896 . . . . 1.0 115.12 -178.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -65.68 151.52 46.34 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 115.511 1.671 . . . . 1.0 115.511 175.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -140.66 160.68 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 127.306 2.242 . . . . 1.0 109.158 -172.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -117.72 144.77 44.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 118.87 -2.393 . . . . 1.0 109.127 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -127.91 157.49 40.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 O-C-N 119.136 -2.227 . . . . 1.0 106.159 167.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -109.35 150.6 27.78 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 125.578 1.551 . . . . 1.0 110.539 161.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.4 t -116.94 124.93 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 171.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.06 130.13 51.66 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 122.654 1.216 . . . . 1.0 111.837 -176.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -88.3 -177.82 47.2 Favored Glycine 0 N--CA 1.434 -1.472 0 CA-C-O 122.763 1.202 . . . . 1.0 115.727 -176.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.11 -25.59 66.28 Favored 'General case' 0 N--CA 1.434 -1.23 0 C-N-CA 125.653 1.581 . . . . 1.0 114.723 -175.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.6 p30 -94.64 1.55 55.58 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 124.662 1.185 . . . . 1.0 111.907 173.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.95 4.85 71.63 Favored Glycine 0 CA--C 1.493 -1.319 0 O-C-N 120.489 -1.382 . . . . 1.0 115.086 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 m -70.25 128.1 35.07 Favored 'General case' 0 CA--C 1.495 -1.151 0 CA-C-N 119.0 1.4 . . . . 1.0 113.206 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -130.51 137.18 56.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-O 122.297 1.046 . . . . 1.0 113.26 -163.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.24 138.81 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.07 0 O-C-N 119.776 -1.827 . . . . 1.0 109.637 160.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.96 139.5 52.37 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-O 123.163 1.459 . . . . 1.0 112.309 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.477 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.0 OUTLIER -145.05 142.57 29.84 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.412 -1.43 . . . . 1.0 113.949 -163.061 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.305 14.0 ttpt -109.34 115.71 30.48 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.696 1.236 . . . . 1.0 114.2 -167.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 14.0 tt -146.28 154.75 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.461 0 CA-C-O 126.183 2.897 . . . . 1.0 110.012 -152.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.428 ' HE2' ' HA ' ' B' ' 973' ' ' ASP . 8.5 mtpp -107.65 158.07 17.56 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 110.768 -2.923 . . . . 1.0 111.413 -171.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -68.96 -37.99 79.14 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 117.275 2.324 . . . . 1.0 117.275 -151.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -87.95 -12.08 45.66 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 120.683 -1.26 . . . . 1.0 113.658 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 94.6 m -60.1 144.28 87.17 Favored Pre-proline 0 N--CA 1.437 -1.077 0 C-N-CA 128.091 2.556 . . . . 1.0 114.315 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -65.66 148.9 87.51 Favored 'Trans proline' 0 N--CA 1.44 -1.647 0 CA-C-N 124.935 2.798 . . . . 1.0 116.04 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.477 ' HA ' HD21 ' A' ' 43' ' ' LEU 0.368 0.6 OUTLIER -64.06 -25.66 68.21 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 115.266 1.58 . . . . 1.0 115.266 169.354 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.1 t -52.49 -29.04 22.94 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 126.917 2.087 . . . . 1.0 112.603 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -67.5 -36.87 81.9 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.431 -1.418 . . . . 1.0 111.822 -178.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.477 HD21 ' HA ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -64.08 -42.25 97.02 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 125.036 1.335 . . . . 1.0 112.144 172.015 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 ttm -58.39 -43.14 88.41 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 113.96 1.096 . . . . 1.0 113.96 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.19 -41.97 94.02 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.258 1.023 . . . . 1.0 112.429 173.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -38.6 90.43 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.525 -1.359 . . . . 1.0 114.459 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -60.98 -41.28 96.15 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 126.37 1.868 . . . . 1.0 111.769 173.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.2 m -62.92 -45.11 94.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.802 -1.186 . . . . 1.0 113.987 171.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -64.52 -51.74 61.34 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 119.944 -1.723 . . . . 1.0 114.618 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -76.43 -43.27 40.91 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 115.028 1.492 . . . . 1.0 115.028 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.63 2.25 25.8 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 121.289 -0.882 . . . . 1.0 110.602 -166.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.54 7.94 85.54 Favored Glycine 0 CA--C 1.493 -1.316 0 N-CA-C 117.576 1.79 . . . . 1.0 117.576 164.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.1 mt -83.79 166.76 17.72 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 119.165 1.482 . . . . 1.0 113.577 -172.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 67.1 m -102.28 131.47 48.84 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.519 -1.363 . . . . 1.0 112.052 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.5 ptp -66.51 -30.38 70.69 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt85 -75.18 -18.51 60.15 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.187 -1.571 . . . . 1.0 113.54 175.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -93.85 -10.62 33.38 Favored 'General case' 0 N--CA 1.435 -1.216 0 O-C-N 120.874 -1.141 . . . . 1.0 112.812 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.6 pt -114.15 146.5 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 C-N-CA 124.233 1.013 . . . . 1.0 111.204 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -136.93 137.08 39.18 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.731 -1.231 . . . . 1.0 108.479 167.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -103.27 148.62 25.61 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.024 -1.048 . . . . 1.0 111.227 -174.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -138.7 162.09 35.54 Favored 'General case' 0 N--CA 1.433 -1.276 0 O-C-N 120.97 -1.081 . . . . 1.0 109.864 174.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -115.33 110.04 18.8 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.561 -0.903 . . . . 1.0 108.561 164.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.5 t0 41.29 55.65 3.28 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.303 2.241 . . . . 1.0 114.738 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 2.32 90.64 Favored Glycine 0 N--CA 1.435 -1.368 0 N-CA-C 117.691 1.836 . . . . 1.0 117.691 -176.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -109.87 119.64 47.01 Favored Pre-proline 0 N--CA 1.435 -1.175 0 CA-C-N 120.954 2.377 . . . . 1.0 110.786 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -46.61 136.98 15.8 Favored 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 124.525 3.483 . . . . 1.0 117.391 165.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 pt -123.26 153.56 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 C-N-CA 125.132 1.373 . . . . 1.0 107.878 177.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -112.6 162.15 16.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.612 -1.305 . . . . 1.0 110.747 -172.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -73.93 -15.25 61.13 Favored 'General case' 0 N--CA 1.436 -1.135 0 O-C-N 119.16 -2.212 . . . . 1.0 115.058 -176.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.8 m -95.16 -3.64 47.52 Favored 'General case' 0 N--CA 1.438 -1.066 0 O-C-N 120.606 -1.309 . . . . 1.0 111.65 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -73.1 169.98 15.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 118.22 -2.8 . . . . 1.0 111.369 169.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 53.2 p -148.32 160.52 36.65 Favored Pre-proline 0 CA--C 1.495 -1.146 0 O-C-N 119.707 -1.871 . . . . 1.0 110.125 -157.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -58.51 -34.52 98.85 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.301 2.667 . . . . 1.0 114.748 167.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.1 -45.99 75.55 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 114.118 1.155 . . . . 1.0 114.118 175.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -70.41 -39.06 74.68 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.115 1.366 . . . . 1.0 114.056 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.6 tp -86.9 -8.49 57.22 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 120.759 -1.213 . . . . 1.0 112.355 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.263 40.7 mt-10 61.97 43.86 8.74 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 126.64 1.976 . . . . 1.0 114.382 177.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.2 mtt -57.23 154.19 10.72 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 128.262 2.625 . . . . 1.0 113.052 167.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -116.99 -177.44 3.2 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 120.981 -1.074 . . . . 1.0 108.848 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.373 10.4 p-10 -57.74 -26.6 62.06 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 126.318 1.847 . . . . 1.0 115.636 -178.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -139.15 85.94 2.1 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.13 1.772 . . . . 1.0 110.344 166.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.28 165.37 16.5 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 120.432 -1.417 . . . . 1.0 113.807 175.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 69.5 m -132.01 121.37 23.79 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.216 1.406 . . . . 1.0 110.677 172.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.2 mm -115.55 140.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 C-N-CA 127.134 2.174 . . . . 1.0 109.315 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -111.16 139.83 46.22 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 120.193 -1.567 . . . . 1.0 111.97 -164.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.9 t -113.15 133.61 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 CA-C-O 122.766 1.27 . . . . 1.0 111.165 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.74 138.11 51.71 Favored 'General case' 0 N--CA 1.433 -1.279 0 CA-C-O 122.554 1.169 . . . . 1.0 110.651 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.7 mm100 -89.43 137.01 32.7 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 124.242 1.017 . . . . 1.0 111.195 -175.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -100.8 164.74 11.71 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 115.219 1.562 . . . . 1.0 115.219 -174.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -124.43 137.16 54.47 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.685 -1.143 . . . . 1.0 111.609 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.7 t -154.03 169.2 24.07 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 120.858 -1.151 . . . . 1.0 109.717 -175.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.93 12.08 84.77 Favored Glycine 0 N--CA 1.437 -1.29 0 O-C-N 119.714 -1.866 . . . . 1.0 116.502 173.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.754 0 O-C-N 121.032 -1.275 . . . . 1.0 110.528 -175.16 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.87 0 N-CA-C 113.503 0.161 . . . . 1.0 113.503 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 11.2 t -75.15 -57.82 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 CA-C-O 123.494 1.616 . . . . 1.0 113.974 -173.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . 0.477 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 7.0 mt -113.21 129.09 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 C-N-CA 127.454 2.302 . . . . 1.0 113.298 -165.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -102.08 129.59 48.46 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.292 -1.505 . . . . 1.0 108.174 167.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.0 167.94 20.51 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 117.919 2.563 . . . . 1.0 117.919 -170.308 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 13.7 p -140.36 175.83 9.27 Favored 'General case' 0 N--CA 1.437 -1.075 0 C-N-CA 129.143 2.977 . . . . 1.0 107.684 -175.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 32.8 ttp 72.82 54.39 0.14 Allowed 'General case' 0 N--CA 1.439 -1.008 0 O-C-N 119.597 -1.939 . . . . 1.0 114.515 176.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 27.6 t0 83.48 12.96 0.39 Allowed 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 127.953 2.501 . . . . 1.0 111.726 -176.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . 0.428 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 1.1 m-20 -113.11 69.62 0.7 Allowed 'General case' 0 N--CA 1.428 -1.539 0 CA-C-O 122.513 1.149 . . . . 1.0 108.596 174.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -62.89 -43.98 97.34 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 116.33 1.974 . . . . 1.0 116.33 -171.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 . . . . . 0 C--O 1.261 1.68 0 C-N-CA 127.561 2.344 . . . . 1.0 110.823 -179.999 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.483 1.21 0 N-CA-C 113.555 0.946 . . . . 1.0 113.555 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.12 -44.97 94.49 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 115.873 1.805 . . . . 1.0 115.873 -174.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -65.69 -47.13 76.45 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.86 -1.15 . . . . 1.0 113.745 177.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -97.68 -4.57 37.06 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 114.949 1.463 . . . . 1.0 114.949 -166.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -68.34 147.75 98.21 Favored Pre-proline 0 N--CA 1.436 -1.166 0 O-C-N 119.904 -1.747 . . . . 1.0 113.433 169.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -55.72 129.78 36.86 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 124.413 3.408 . . . . 1.0 116.996 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -66.2 147.89 52.65 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 124.717 1.207 . . . . 1.0 113.704 170.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -130.41 130.79 44.78 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 121.13 -0.982 . . . . 1.0 112.863 -165.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.2 21.37 58.94 Favored Glycine 0 N--CA 1.437 -1.241 0 N-CA-C 116.72 1.448 . . . . 1.0 116.72 167.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.5 t -65.58 -42.64 93.42 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 O-C-N 121.034 -1.274 . . . . 1.0 113.911 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -62.32 140.41 58.51 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 115.329 1.603 . . . . 1.0 115.329 176.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.3 t -156.81 156.18 32.8 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 175.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.272 46.6 mt-10 61.88 159.11 0.06 Allowed 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 126.533 1.933 . . . . 1.0 114.739 -162.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.0 m120 54.16 56.72 6.66 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 116.121 1.897 . . . . 1.0 116.121 173.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -148.7 173.7 12.95 Favored 'General case' 0 N--CA 1.434 -1.243 0 O-C-N 120.949 -1.094 . . . . 1.0 110.188 -173.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -109.11 19.44 19.5 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.878 -1.138 . . . . 1.0 113.135 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.5 m170 -76.17 140.33 41.67 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 120.549 -1.344 . . . . 1.0 112.618 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 24.7 pt -143.03 160.65 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 126.394 1.877 . . . . 1.0 106.951 170.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -117.71 144.8 44.92 Favored 'General case' 0 N--CA 1.432 -1.33 0 O-C-N 119.3 -2.125 . . . . 1.0 108.982 176.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -127.5 146.04 50.64 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 119.938 -1.726 . . . . 1.0 107.455 168.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -106.45 150.62 25.89 Favored 'General case' 0 CA--C 1.493 -1.22 0 O-C-N 120.111 -1.618 . . . . 1.0 111.311 165.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.4 p -119.22 124.52 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 N-CA-C 107.106 -1.442 . . . . 1.0 107.106 172.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 130.2 49.07 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 123.083 1.42 . . . . 1.0 112.739 -171.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -87.86 -179.02 47.59 Favored Glycine 0 N--CA 1.434 -1.442 0 CA-C-O 123.256 1.476 . . . . 1.0 115.801 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -91.36 -8.88 46.78 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 126.797 2.039 . . . . 1.0 109.474 175.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -112.3 7.27 19.26 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 127.761 2.424 . . . . 1.0 111.498 -173.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.43 3.88 90.54 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 116.839 1.495 . . . . 1.0 116.839 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -82.09 127.99 33.67 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 118.55 1.175 . . . . 1.0 111.656 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.4 t -139.86 140.11 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 O-C-N 121.286 -0.884 . . . . 1.0 110.922 -170.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -128.04 137.88 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 N-CA-C 106.08 -1.822 . . . . 1.0 106.08 163.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.73 140.15 50.07 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-O 123.61 1.671 . . . . 1.0 111.269 161.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.467 ' CE2' ' HA ' ' A' ' 43' ' ' LEU 0.355 10.8 t80 -139.91 140.48 36.44 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 -155.141 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.279 27.3 ttpt -115.02 115.64 27.16 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-O 122.403 1.097 . . . . 1.0 111.013 -171.191 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.1 tt -140.09 154.7 23.46 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-O 124.216 1.96 . . . . 1.0 111.997 -155.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -100.24 157.3 16.69 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 123.282 1.515 . . . . 1.0 111.758 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 ttt-85 -71.25 -23.12 61.93 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 117.848 2.536 . . . . 1.0 117.848 -154.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -90.44 -19.68 23.62 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.039 -1.663 . . . . 1.0 112.438 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.5 m -60.9 140.45 93.62 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 126.33 1.852 . . . . 1.0 114.132 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -68.62 152.05 74.76 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 CA-C-N 124.052 2.483 . . . . 1.0 116.308 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.291 0.4 OUTLIER -69.06 -25.47 64.47 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 126.657 1.983 . . . . 1.0 112.41 168.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 89.9 p -52.69 -29.15 25.02 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.098 -2.251 . . . . 1.0 115.024 173.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -67.74 -36.07 79.88 Favored 'General case' 0 N--CA 1.427 -1.614 0 O-C-N 119.75 -1.844 . . . . 1.0 110.686 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.467 ' HA ' ' CE2' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -63.57 -41.94 98.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 127.553 2.341 . . . . 1.0 112.497 171.011 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 56.1 ttm -61.53 -44.49 96.96 Favored 'General case' 0 N--CA 1.433 -1.28 0 O-C-N 120.857 -1.152 . . . . 1.0 113.7 174.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -67.21 -40.08 86.4 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.226 -0.921 . . . . 1.0 112.747 176.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.99 -38.6 91.49 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.763 -1.21 . . . . 1.0 113.686 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -59.77 -40.11 87.1 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.218 1.807 . . . . 1.0 111.907 170.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.9 m -67.72 -44.4 77.74 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.629 -1.92 . . . . 1.0 114.489 172.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.42 -46.51 76.26 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.054 -1.654 . . . . 1.0 114.045 179.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 24.6 mtt180 -78.59 -42.19 29.71 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 116.572 2.064 . . . . 1.0 116.572 177.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.15 4.83 25.29 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.8 -1.187 . . . . 1.0 112.001 -166.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.11 5.72 85.46 Favored Glycine 0 N--CA 1.438 -1.22 0 N-CA-C 117.856 1.902 . . . . 1.0 117.856 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.15 165.5 20.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.916 -1.344 . . . . 1.0 113.748 -173.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -102.34 129.71 48.87 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.326 -1.484 . . . . 1.0 111.036 171.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -66.47 -22.52 66.2 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 119.835 -1.791 . . . . 1.0 115.464 -172.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -91.29 3.87 53.77 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 124.937 1.295 . . . . 1.0 112.513 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -112.91 -6.12 13.8 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 124.622 1.169 . . . . 1.0 112.4 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 31.6 pt -124.35 142.46 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.694 -1.253 . . . . 1.0 110.263 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -138.21 154.93 49.09 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 124.86 1.264 . . . . 1.0 108.159 172.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -116.04 148.71 39.9 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-O 123.028 1.394 . . . . 1.0 112.923 -167.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -136.3 152.55 50.81 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-O 122.421 1.105 . . . . 1.0 110.072 175.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -130.55 111.58 12.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.728 1.211 . . . . 1.0 108.733 -178.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.8 t70 48.63 44.85 21.42 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 126.409 1.883 . . . . 1.0 113.997 -174.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.5 1.69 88.96 Favored Glycine 0 N--CA 1.436 -1.323 0 N-CA-C 117.051 1.58 . . . . 1.0 117.051 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -109.96 137.7 20.56 Favored Pre-proline 0 N--CA 1.436 -1.175 0 CA-C-N 119.978 1.889 . . . . 1.0 110.365 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.74 144.99 36.05 Favored 'Trans proline' 0 N--CA 1.44 -1.659 0 C-N-CA 122.616 2.211 . . . . 1.0 112.466 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.0 pt -120.75 151.28 23.64 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.141 0 C-N-CA 124.644 1.177 . . . . 1.0 108.828 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -112.7 163.42 14.58 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.8 -1.188 . . . . 1.0 109.803 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -70.19 -13.94 62.41 Favored 'General case' 0 N--CA 1.436 -1.142 0 O-C-N 119.726 -1.859 . . . . 1.0 112.895 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.0 m -84.55 -11.84 55.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 125.948 1.699 . . . . 1.0 112.164 171.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -83.43 173.19 11.72 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.449 -2.032 . . . . 1.0 110.721 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 76.9 p -153.48 159.23 32.38 Favored Pre-proline 0 CA--C 1.498 -1.055 0 O-C-N 120.748 -1.22 . . . . 1.0 111.027 -161.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.87 -32.27 95.05 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 C-N-CA 123.616 2.877 . . . . 1.0 115.17 171.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.29 -46.03 78.37 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-O 122.54 1.162 . . . . 1.0 113.59 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -69.58 -40.77 76.53 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 125.424 1.49 . . . . 1.0 113.452 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 16.4 tp -87.74 -8.4 56.09 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.811 -1.18 . . . . 1.0 111.696 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 60.13 48.25 8.59 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 127.5 2.32 . . . . 1.0 114.443 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.66 151.29 25.25 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 127.169 2.188 . . . . 1.0 115.081 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -105.6 175.95 5.32 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.089 1.756 . . . . 1.0 110.518 -175.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -56.26 -26.59 52.18 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 126.297 1.839 . . . . 1.0 115.528 176.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.73 89.69 2.34 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 124.438 1.095 . . . . 1.0 108.826 163.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.86 169.68 12.33 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.187 -1.57 . . . . 1.0 114.283 174.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.9 m -130.84 118.07 20.25 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 124.809 1.243 . . . . 1.0 111.012 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 24.2 mm -105.74 140.56 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 127.575 2.35 . . . . 1.0 107.981 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -110.98 142.58 42.92 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 120.445 -1.409 . . . . 1.0 109.2 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.5 139.64 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 O-C-N 120.494 -1.379 . . . . 1.0 109.297 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -123.71 140.67 52.76 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.714 -1.217 . . . . 1.0 107.714 165.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -86.03 133.12 33.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 120.966 -1.084 . . . . 1.0 109.893 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -139.24 151.46 46.53 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.939 -1.101 . . . . 1.0 112.532 -163.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -117.89 146.19 44.1 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.069 1.348 . . . . 1.0 108.472 176.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.7 t -56.18 145.15 27.15 Favored 'General case' 0 N--CA 1.438 -1.059 0 C-N-CA 125.024 1.33 . . . . 1.0 113.996 173.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -98.78 -2.04 57.36 Favored Glycine 0 CA--C 1.493 -1.341 0 O-C-N 120.588 -1.32 . . . . 1.0 113.326 177.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.733 0 CA-C-N 118.003 0.901 . . . . 1.0 111.52 -179.233 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.891 0 N-CA-C 115.276 0.871 . . . . 1.0 115.276 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 42.0 t -97.16 -69.28 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.189 0 CA-C-O 123.765 1.745 . . . . 1.0 110.836 173.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 2.3 mt -113.12 118.43 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 C-N-CA 127.811 2.444 . . . . 1.0 111.432 -167.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -102.12 114.24 28.2 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.021 -1.674 . . . . 1.0 109.19 169.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.21 141.51 39.85 Favored 'General case' 0 CA--C 1.497 -1.07 0 CA-C-N 121.725 2.057 . . . . 1.0 115.476 -175.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 58.5 p -106.32 -10.88 16.19 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 125.488 1.515 . . . . 1.0 111.717 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -59.46 137.14 58.11 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 126.727 2.011 . . . . 1.0 113.183 171.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 42.1 t0 78.87 107.63 0.07 Allowed 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 128.348 2.659 . . . . 1.0 107.327 -167.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -90.02 36.09 0.86 Allowed 'General case' 0 N--CA 1.435 -1.21 0 O-C-N 119.946 -1.721 . . . . 1.0 114.387 -154.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -76.94 72.26 3.5 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 126.171 1.789 . . . . 1.0 110.177 162.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 C--O 1.26 1.639 0 C-N-CA 126.559 1.944 . . . . 1.0 115.815 -166.772 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 tpt . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 113.426 0.899 . . . . 1.0 113.426 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.24 -43.13 87.47 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 115.482 1.66 . . . . 1.0 115.482 -175.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -116.86 109.32 16.92 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 120.964 -1.085 . . . . 1.0 109.286 -178.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -154.26 158.13 39.76 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 108.504 -0.924 . . . . 1.0 108.504 173.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -93.57 126.06 51.43 Favored Pre-proline 0 N--CA 1.435 -1.215 0 CA-C-O 117.815 -1.088 . . . . 1.0 109.994 173.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -49.54 134.22 32.59 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 124.363 3.375 . . . . 1.0 117.111 171.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.63 -36.82 43.48 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 115.027 1.491 . . . . 1.0 115.027 -179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 62.85 27.47 16.03 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 117.257 2.318 . . . . 1.0 117.257 167.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 78.19 2.74 84.05 Favored Glycine 0 CA--C 1.493 -1.321 0 O-C-N 120.096 -1.627 . . . . 1.0 114.241 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.2 m -124.94 22.98 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.216 0 C-N-CA 125.27 1.428 . . . . 1.0 109.879 -173.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.68 146.35 0.07 Allowed 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 119.061 2.985 . . . . 1.0 119.061 177.192 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.7 p -74.05 163.76 27.48 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 115.231 1.567 . . . . 1.0 115.231 -173.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -142.5 -7.28 0.88 Allowed 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 113.56 0.948 . . . . 1.0 113.56 179.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -112.88 139.56 48.41 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.685 -1.259 . . . . 1.0 110.953 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -106.71 138.23 43.27 Favored 'General case' 0 N--CA 1.436 -1.136 0 O-C-N 120.546 -1.346 . . . . 1.0 111.799 -171.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.4 p-10 -160.19 175.59 12.73 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.411 2.285 . . . . 1.0 105.947 175.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.2 p-80 -58.77 163.25 3.45 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 118.602 2.816 . . . . 1.0 118.602 176.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 pt -139.39 160.78 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 C-N-CA 129.43 3.092 . . . . 1.0 107.297 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -111.94 144.86 40.58 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 119.844 -1.785 . . . . 1.0 109.926 165.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.15 156.69 46.94 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 119.361 -2.087 . . . . 1.0 107.071 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 ptpt -125.37 150.67 47.0 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 126.363 1.865 . . . . 1.0 112.833 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -117.55 124.82 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 125.295 1.438 . . . . 1.0 107.88 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.9 130.19 51.87 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-O 122.613 1.196 . . . . 1.0 113.418 -176.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -87.66 -177.16 48.22 Favored Glycine 0 N--CA 1.435 -1.386 0 C-N-CA 124.823 1.201 . . . . 1.0 113.349 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -75.68 -15.62 60.29 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.915 -1.344 . . . . 1.0 113.168 -177.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.9 p-10 -90.93 0.38 57.52 Favored 'General case' 0 N--CA 1.433 -1.293 0 C-N-CA 125.101 1.36 . . . . 1.0 111.577 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.57 0.16 89.75 Favored Glycine 0 CA--C 1.493 -1.331 0 C-N-CA 126.088 1.804 . . . . 1.0 113.668 179.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.4 m -70.67 128.12 35.0 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 124.936 1.295 . . . . 1.0 111.021 177.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.5 p -139.85 132.05 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.179 0 O-C-N 121.462 -0.774 . . . . 1.0 111.973 -166.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -129.17 138.72 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 O-C-N 120.619 -1.301 . . . . 1.0 109.923 176.069 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.75 146.56 46.92 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 124.025 1.869 . . . . 1.0 114.619 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.61 146.39 47.86 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.857 -1.777 . . . . 1.0 107.952 -163.03 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.255 37.5 ttpt -112.04 115.76 29.44 Favored 'General case' 0 CA--C 1.494 -1.188 0 O-C-N 120.482 -1.386 . . . . 1.0 111.822 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.98 154.58 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-O 124.24 1.971 . . . . 1.0 110.972 -160.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.31 158.97 19.55 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.608 -2.087 . . . . 1.0 112.625 -176.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ttt-85 -71.31 -38.02 71.77 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 115.817 1.784 . . . . 1.0 115.817 -161.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -91.06 -16.61 27.6 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.769 -1.207 . . . . 1.0 113.571 -178.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 63.8 m -63.37 138.18 97.28 Favored Pre-proline 0 N--CA 1.437 -1.117 0 C-N-CA 125.331 1.452 . . . . 1.0 112.566 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -65.74 156.27 64.85 Favored 'Trans proline' 0 N--CA 1.44 -1.66 0 CA-C-N 124.023 2.473 . . . . 1.0 116.306 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.422 1.8 pp -61.39 -25.62 67.3 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 126.317 1.847 . . . . 1.0 114.006 172.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 93.2 p -52.58 -29.02 23.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.944 -1.722 . . . . 1.0 114.879 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -42.66 77.4 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.5 -2.0 . . . . 1.0 112.73 -174.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.14 -35.44 80.48 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.362 -1.461 . . . . 1.0 113.208 170.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.9 ttt -61.42 -41.75 97.66 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.193 -1.567 . . . . 1.0 114.805 173.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.96 -43.03 99.69 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 125.761 1.624 . . . . 1.0 111.989 172.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.73 81.95 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 174.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -59.79 -43.42 94.44 Favored 'General case' 0 N--CA 1.437 -1.112 0 C-N-CA 126.213 1.805 . . . . 1.0 111.662 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.5 m -60.39 -43.41 96.68 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 125.249 1.419 . . . . 1.0 114.174 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.75 -51.55 54.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 114.99 1.478 . . . . 1.0 114.99 174.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -42.29 59.3 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.761 -1.212 . . . . 1.0 113.749 -172.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -112.33 0.47 15.7 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 113.053 0.76 . . . . 1.0 113.053 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 41.46 28.52 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 118.093 1.997 . . . . 1.0 118.093 163.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.4 mt -121.58 168.02 12.22 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.282 1.433 . . . . 1.0 111.215 -171.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 t -102.22 133.04 47.74 Favored 'General case' 0 N--CA 1.436 -1.149 0 O-C-N 120.502 -1.374 . . . . 1.0 112.927 176.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 23.8 ptp -66.55 -18.57 65.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.397 1.628 . . . . 1.0 115.397 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -96.59 1.52 51.33 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.613 -1.304 . . . . 1.0 113.061 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -110.37 -31.5 7.27 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 119.722 -1.861 . . . . 1.0 111.769 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.2 pp -115.27 135.25 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 O-C-N 121.615 -0.678 . . . . 1.0 110.661 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -132.75 154.93 49.74 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.137 -1.602 . . . . 1.0 111.329 -171.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -104.17 148.66 26.04 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.297 -1.502 . . . . 1.0 113.055 -166.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -147.34 145.1 29.2 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 125.079 1.352 . . . . 1.0 108.213 -171.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -129.97 110.29 11.55 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 120.615 -1.303 . . . . 1.0 109.026 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 52.57 47.15 25.31 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.757 2.023 . . . . 1.0 114.038 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.93 4.89 86.39 Favored Glycine 0 N--CA 1.435 -1.416 0 O-C-N 120.371 -1.456 . . . . 1.0 116.289 -176.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -114.6 132.2 22.99 Favored Pre-proline 0 N--CA 1.434 -1.238 0 CA-C-N 120.386 2.093 . . . . 1.0 109.08 -177.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.63 135.26 34.05 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 123.869 3.046 . . . . 1.0 115.797 163.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 4.7 pt -119.66 142.85 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 105.943 -1.873 . . . . 1.0 105.943 174.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -100.14 158.25 15.99 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.796 -1.19 . . . . 1.0 108.574 -169.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -66.12 -26.0 67.25 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 119.382 -2.074 . . . . 1.0 113.569 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.3 m -78.48 -12.63 60.02 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 126.215 1.806 . . . . 1.0 113.213 171.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.94 172.64 11.9 Favored 'General case' 0 N--CA 1.432 -1.343 0 O-C-N 118.663 -2.523 . . . . 1.0 111.711 174.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 54.4 p -148.11 160.83 36.39 Favored Pre-proline 0 CA--C 1.495 -1.143 0 O-C-N 120.094 -1.629 . . . . 1.0 109.24 -159.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 99.7 Cg_exo -55.83 -36.14 94.9 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.275 2.65 . . . . 1.0 115.909 164.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.45 -45.7 82.72 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 114.124 1.157 . . . . 1.0 114.124 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -71.66 -43.16 66.55 Favored 'General case' 0 N--CA 1.433 -1.299 0 C-N-CA 124.694 1.197 . . . . 1.0 111.886 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -4.56 56.41 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.81 0.814 . . . . 1.0 111.754 -175.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.267 51.2 mt-10 60.02 48.33 8.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 C-N-CA 127.129 2.172 . . . . 1.0 115.106 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.9 mtt -73.64 153.6 40.08 Favored 'General case' 0 N--CA 1.432 -1.335 0 C-N-CA 126.653 1.981 . . . . 1.0 111.675 173.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.594 ' HG3' ' H ' ' A' ' 81' ' ' GLU . 10.7 pt-20 -118.14 178.7 4.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 O-C-N 120.568 -1.333 . . . . 1.0 110.606 -168.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.259 9.6 p-10 -52.92 -26.55 15.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.987 2.515 . . . . 1.0 116.556 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.594 ' H ' ' HG3' ' A' ' 79' ' ' GLU . 50.9 mt-10 -136.61 66.32 1.48 Allowed 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 125.12 1.368 . . . . 1.0 111.854 167.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.73 167.35 19.22 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 116.966 2.21 . . . . 1.0 116.966 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.4 m -127.63 125.38 40.07 Favored 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 126.17 1.788 . . . . 1.0 112.121 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 73.9 mt -114.33 140.76 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 C-N-CA 129.233 3.013 . . . . 1.0 109.172 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -110.9 141.48 44.26 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.965 1.706 . . . . 1.0 106.597 -171.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.7 t -108.54 131.6 58.68 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.257 0 O-C-N 120.783 -1.198 . . . . 1.0 108.82 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -118.46 135.31 54.44 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 123.456 1.598 . . . . 1.0 111.822 164.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.14 140.5 29.4 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 125.414 1.486 . . . . 1.0 111.816 -172.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 -121.08 3.96 10.42 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 121.077 -1.014 . . . . 1.0 111.67 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -56.66 -45.12 81.86 Favored 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 126.521 1.928 . . . . 1.0 115.772 -175.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 34.7 p -99.24 -3.85 33.3 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.525 -1.36 . . . . 1.0 111.607 -175.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 63.26 -179.15 5.94 Favored Glycine 0 N--CA 1.435 -1.382 0 C-N-CA 125.964 1.745 . . . . 1.0 116.74 -177.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.749 0 O-C-N 120.717 -1.461 . . . . 1.0 109.673 -177.126 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.937 0 CA-C-O 120.256 -0.191 . . . . 1.0 113.442 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.292 0.2 OUTLIER -74.92 -50.28 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 N-CA-C 116.381 1.993 . . . . 1.0 116.381 -166.482 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -113.05 115.22 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 124.573 1.149 . . . . 1.0 109.276 -168.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -102.16 122.94 45.13 Favored 'General case' 0 N--CA 1.434 -1.237 0 O-C-N 120.139 -1.6 . . . . 1.0 110.364 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -91.96 140.96 29.15 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.167 -1.583 . . . . 1.0 114.989 -175.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 23.2 m -122.64 131.56 53.87 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 105.531 -2.026 . . . . 1.0 105.531 165.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.47 168.75 24.43 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.884 -1.135 . . . . 1.0 109.782 -174.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.43 -43.48 90.31 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 125.87 1.668 . . . . 1.0 115.182 -168.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -61.56 140.43 58.12 Favored 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 125.801 1.64 . . . . 1.0 113.658 -173.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -58.09 134.47 56.47 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 114.276 1.213 . . . . 1.0 114.276 174.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.272 40.3 tt0 . . . . . 0 C--O 1.262 1.743 0 N-CA-C 115.121 1.526 . . . . 1.0 115.121 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.433 -1.317 0 CA-C-O 121.77 0.795 . . . . 1.0 112.609 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.9 pt -143.03 160.72 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 C-N-CA 131.29 3.836 . . . . 1.0 106.541 -174.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -116.05 144.85 43.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.769 -2.457 . . . . 1.0 110.566 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.459 HD22 HG21 ' A' ' 34' ' ' ILE . 1.8 pt? -132.25 157.2 44.97 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 119.375 -2.078 . . . . 1.0 106.084 173.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.3 ptpt -122.25 150.0 42.91 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 120.009 -1.682 . . . . 1.0 110.456 168.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.46 126.05 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.01 130.21 53.1 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 122.876 1.322 . . . . 1.0 112.114 -176.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.505 0 CA-C-O 123.351 1.528 . . . . 1.0 115.133 178.61 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.436 -1.13 0 N-CA-C 112.782 0.66 . . . . 1.0 112.782 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.549 ' CG2' HG21 ' B' ' 966' ' ' VAL . 0.4 OUTLIER -129.19 138.78 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.067 0 O-C-N 120.566 -1.334 . . . . 1.0 110.178 170.174 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.511 HE21 ' N ' ' B' ' 966' ' ' VAL . 3.3 pp0? -104.07 158.49 16.39 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 123.406 1.574 . . . . 1.0 112.687 174.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.482 ' CD2' HD13 ' B' ' 967' ' ' ILE . 0.1 OUTLIER -145.03 152.49 40.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.725 -1.125 . . . . 1.0 108.099 -173.285 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -124.12 118.3 26.6 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.768 -1.568 . . . . 1.0 106.768 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.568 ' HA ' HD21 ' B' ' 969' ' ' LEU . 12.7 tt -144.49 154.83 14.84 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 C-N-CA 128.247 2.619 . . . . 1.0 111.113 -154.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -102.09 157.11 17.12 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 112.054 -2.339 . . . . 1.0 112.118 -177.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.09 -37.97 78.73 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 115.816 1.784 . . . . 1.0 115.816 -158.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -82.77 -17.97 42.32 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 114.344 1.238 . . . . 1.0 114.344 176.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 31.9 m -61.59 131.75 92.8 Favored Pre-proline 0 N--CA 1.438 -1.032 0 C-N-CA 125.479 1.511 . . . . 1.0 112.148 -175.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.78 157.08 62.96 Favored 'Trans proline' 0 N--CA 1.441 -1.606 0 CA-C-N 124.881 2.779 . . . . 1.0 114.914 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.433 2.7 pp -61.98 -25.55 67.69 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 124.958 1.303 . . . . 1.0 114.484 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.0 p -52.67 -29.02 24.2 Favored 'General case' 0 N--CA 1.435 -1.218 0 O-C-N 119.803 -1.811 . . . . 1.0 114.897 171.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -44.17 65.43 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 119.754 -1.841 . . . . 1.0 111.521 -175.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -35.58 80.0 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.898 -1.126 . . . . 1.0 111.957 175.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 ttm -61.65 -42.09 98.42 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 119.778 -1.826 . . . . 1.0 114.11 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 ttpt -69.14 -37.17 78.15 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.147 -1.595 . . . . 1.0 112.503 175.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.65 83.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 114.238 1.199 . . . . 1.0 114.238 171.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -59.13 -43.31 91.97 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.911 -1.743 . . . . 1.0 111.897 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 81.2 m -62.53 -42.46 99.54 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 125.009 1.323 . . . . 1.0 113.769 175.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.14 -48.89 78.08 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 124.594 1.157 . . . . 1.0 113.754 175.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -78.57 -43.16 27.25 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 114.85 1.426 . . . . 1.0 114.85 -174.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -114.16 9.59 17.18 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.934 -1.104 . . . . 1.0 112.793 -165.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.08 46.99 8.75 Favored Glycine 0 CA--C 1.493 -1.281 0 N-CA-C 117.67 1.828 . . . . 1.0 117.67 161.105 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.7 mt -125.59 160.95 28.32 Favored 'General case' 0 N--CA 1.436 -1.167 0 C-N-CA 124.566 1.147 . . . . 1.0 109.825 -170.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 m -102.28 133.81 46.59 Favored 'General case' 0 CA--C 1.496 -1.118 0 O-C-N 120.295 -1.503 . . . . 1.0 110.218 172.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -63.74 -32.59 74.13 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 116.527 2.047 . . . . 1.0 116.527 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -78.99 -14.71 59.04 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.19 -1.569 . . . . 1.0 114.024 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -87.73 -16.83 33.14 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.882 -1.136 . . . . 1.0 112.616 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.1 pt -116.37 140.47 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 O-C-N 120.814 -1.179 . . . . 1.0 108.987 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -138.21 146.33 42.49 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 107.265 -1.383 . . . . 1.0 107.265 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.1 m-30 -107.15 148.58 28.66 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.505 1.145 . . . . 1.0 110.663 -170.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -131.98 153.95 49.81 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 124.844 1.258 . . . . 1.0 109.346 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -126.12 108.69 11.57 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 165.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 48.71 50.49 17.21 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.098 2.159 . . . . 1.0 115.371 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.62 6.57 89.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 116.186 1.234 . . . . 1.0 116.186 -177.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -110.62 127.67 26.58 Favored Pre-proline 0 N--CA 1.435 -1.199 0 CA-C-N 119.564 1.682 . . . . 1.0 109.411 176.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -56.13 135.23 68.84 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 123.237 2.624 . . . . 1.0 115.54 166.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.4 pt -119.29 137.6 52.69 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 106.236 -1.764 . . . . 1.0 106.236 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -112.67 163.83 14.08 Favored 'General case' 0 N--CA 1.435 -1.206 0 O-C-N 120.717 -1.239 . . . . 1.0 108.433 -162.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -61.44 -28.3 69.17 Favored 'General case' 0 CA--C 1.497 -1.092 0 O-C-N 118.98 -2.325 . . . . 1.0 115.731 -175.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.1 m -78.51 -13.93 59.6 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 126.086 1.754 . . . . 1.0 112.459 175.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -75.89 168.93 19.12 Favored 'General case' 0 N--CA 1.432 -1.357 0 O-C-N 119.627 -1.92 . . . . 1.0 111.363 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p -151.43 161.72 28.83 Favored Pre-proline 0 CA--C 1.497 -1.081 0 O-C-N 119.878 -1.764 . . . . 1.0 111.047 -154.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -60.4 -31.69 92.98 Favored 'Trans proline' 0 N--CA 1.44 -1.649 0 C-N-CA 123.6 2.867 . . . . 1.0 115.417 168.096 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.87 -45.5 70.85 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 122.508 1.147 . . . . 1.0 112.65 173.391 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -70.48 -42.81 70.89 Favored 'General case' 0 N--CA 1.433 -1.295 0 C-N-CA 125.501 1.521 . . . . 1.0 113.729 -177.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 25.9 tp -85.82 -8.46 58.08 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.557 -1.339 . . . . 1.0 113.008 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 67.39 42.63 2.15 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.549 1.539 . . . . 1.0 113.608 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 63.9 mtt -62.3 148.73 44.11 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 127.065 2.146 . . . . 1.0 115.184 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -91.53 176.48 6.53 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.472 1.509 . . . . 1.0 111.431 -178.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.259 12.1 p-10 -58.16 -26.39 62.66 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.437 2.295 . . . . 1.0 114.477 168.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -138.26 79.15 1.72 Allowed 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 125.35 1.46 . . . . 1.0 109.686 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.68 162.44 21.82 Favored 'General case' 0 N--CA 1.437 -1.094 0 O-C-N 120.021 -1.674 . . . . 1.0 112.483 176.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.8 m -131.21 118.57 20.62 Favored 'General case' 0 CA--C 1.496 -1.11 0 C-N-CA 124.297 1.039 . . . . 1.0 110.332 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mm -119.18 140.6 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 C-N-CA 126.828 2.051 . . . . 1.0 108.937 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -111.05 149.45 30.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.281 -1.512 . . . . 1.0 110.989 -170.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.0 t -115.76 139.63 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 O-C-N 120.665 -1.272 . . . . 1.0 110.625 -174.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -121.63 142.87 49.7 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.426 -0.953 . . . . 1.0 108.426 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -89.56 120.29 30.73 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 120.864 -1.147 . . . . 1.0 109.216 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 . . . . . 0 N--CA 1.435 -1.213 0 N-CA-C 114.822 1.415 . . . . 1.0 114.822 -154.874 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 966' ' ' VAL . . . . . 0.549 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.481 0.3 OUTLIER . . . . . 0 N--CA 1.434 -1.252 0 N-CA-C 112.635 0.606 . . . . 1.0 112.635 . . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 967' ' ' ILE . . . . . 0.482 HD13 ' CD2' ' A' ' 32' ' ' PHE . 4.9 mt -88.82 116.61 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 O-C-N 119.857 -1.777 . . . . 1.0 113.259 -163.236 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -102.17 109.24 20.88 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 118.903 -2.373 . . . . 1.0 109.132 160.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.053 0 O-C-N 119.651 -1.906 . . . . 1.0 114.389 -168.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 m80 . . . . . 0 N--CA 1.431 -1.417 0 CA-C-O 122.67 1.224 . . . . 1.0 109.271 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.7 pt -139.38 160.7 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 126.461 1.904 . . . . 1.0 107.282 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -117.7 144.73 44.98 Favored 'General case' 0 N--CA 1.432 -1.329 0 N-CA-C 106.092 -1.818 . . . . 1.0 106.092 170.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.7 156.06 45.56 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 105.256 -2.128 . . . . 1.0 105.256 168.189 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -115.72 150.61 36.55 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 125.786 1.635 . . . . 1.0 109.91 169.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.411 HG11 ' CZ ' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -111.28 127.59 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.675 0 N-CA-C 105.719 -1.956 . . . . 1.0 105.719 171.619 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -130.3 130.15 44.14 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.163 0.982 . . . . 1.0 111.581 -174.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.395 0 N-CA-C 108.548 -1.821 . . . . 1.0 108.548 172.782 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.437 -1.115 0 N-CA-C 112.273 0.472 . . . . 1.0 112.273 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.258 0.4 OUTLIER -129.25 138.8 53.45 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.083 0 O-C-N 119.636 -1.915 . . . . 1.0 110.531 158.535 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.06 139.54 53.18 Favored 'General case' 0 CA--C 1.494 -1.202 0 CA-C-O 123.425 1.583 . . . . 1.0 113.479 175.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.496 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.1 OUTLIER -144.06 146.86 33.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.745 -1.222 . . . . 1.0 112.963 -165.339 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.269 20.5 ttpt -112.78 115.85 29.15 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.858 1.263 . . . . 1.0 113.371 -166.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.9 154.67 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 123.576 1.655 . . . . 1.0 110.878 -152.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -106.63 165.72 11.09 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 123.298 1.523 . . . . 1.0 114.217 -170.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -62.97 -38.17 90.04 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.193 2.294 . . . . 1.0 117.193 -159.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.28 15.88 21.58 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.536 -1.353 . . . . 1.0 113.764 -178.05 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 16.1 m -84.08 135.93 41.58 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 124.855 1.262 . . . . 1.0 111.723 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.13 152.6 76.19 Favored 'Trans proline' 0 N--CA 1.441 -1.571 0 C-N-CA 123.039 2.492 . . . . 1.0 114.576 173.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.332 3.4 pp -61.88 -25.69 67.7 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 114.405 1.261 . . . . 1.0 114.405 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 83.7 p -52.72 -29.06 24.81 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 119.538 -1.976 . . . . 1.0 116.067 166.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -74.55 -45.88 42.68 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 119.557 -1.965 . . . . 1.0 110.618 -167.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.739 HD13 ' H ' ' A' ' 43' ' ' LEU 0.327 0.0 OUTLIER -68.85 -31.13 69.86 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.695 1.368 . . . . 1.0 114.695 170.233 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 18.4 ttt -61.04 -41.72 97.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.397 -2.065 . . . . 1.0 114.065 173.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -41.52 98.65 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 120.876 -1.14 . . . . 1.0 112.418 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.61 -36.84 81.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.118 1.525 . . . . 1.0 115.118 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -58.94 -43.86 91.28 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 120.025 -1.672 . . . . 1.0 112.185 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.2 m -62.3 -42.36 99.3 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.009 1.324 . . . . 1.0 113.02 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -67.19 -51.52 52.51 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 113.464 0.913 . . . . 1.0 113.464 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.7 -40.68 72.72 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 115.067 1.506 . . . . 1.0 115.067 -174.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -111.13 9.82 21.94 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.915 -1.116 . . . . 1.0 112.513 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.34 Favored Glycine 0 CA--C 1.493 -1.303 0 N-CA-C 115.871 1.108 . . . . 1.0 115.871 164.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.3 mt -116.92 160.41 20.95 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.73 -0.865 . . . . 1.0 111.725 -169.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.0 m -102.23 134.5 45.41 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 121.073 -1.017 . . . . 1.0 109.071 175.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 tpp -61.4 -37.91 85.16 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 127.276 2.23 . . . . 1.0 114.08 -165.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -95.82 1.38 53.12 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.481 -0.781 . . . . 1.0 112.072 -176.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -102.15 -3.98 26.58 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.342 1.057 . . . . 1.0 111.694 177.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.9 pt -123.33 146.12 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 124.471 1.108 . . . . 1.0 108.991 168.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -138.26 148.78 45.07 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 120.65 -1.281 . . . . 1.0 107.682 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.411 ' CZ ' HG11 ' A' ' 22' ' ' VAL . 20.2 m-30 -103.32 147.54 26.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 122.757 1.265 . . . . 1.0 111.854 -176.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -131.19 161.19 32.74 Favored 'General case' 0 N--CA 1.433 -1.317 0 C-N-CA 125.809 1.643 . . . . 1.0 108.135 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -138.57 124.12 19.58 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 107.615 -1.254 . . . . 1.0 107.615 165.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.4 t0 58.54 32.53 22.23 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.591 1.556 . . . . 1.0 114.859 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.42 8.47 87.53 Favored Glycine 0 N--CA 1.435 -1.382 0 O-C-N 119.953 -1.717 . . . . 1.0 116.104 -173.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -117.14 142.14 29.58 Favored Pre-proline 0 N--CA 1.434 -1.234 0 CA-C-N 119.028 1.414 . . . . 1.0 108.481 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -74.7 142.4 28.82 Favored 'Trans proline' 0 C--N 1.307 -1.617 0 CA-C-N 123.286 2.209 . . . . 1.0 112.271 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 pt -116.83 143.84 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 N-CA-C 106.571 -1.64 . . . . 1.0 106.571 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -89.52 154.69 19.81 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 119.592 -1.943 . . . . 1.0 109.815 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -61.06 -27.71 68.54 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 118.845 -2.409 . . . . 1.0 115.217 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 m -95.51 5.64 51.02 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 124.218 1.007 . . . . 1.0 111.758 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -74.56 174.89 8.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.256 -2.153 . . . . 1.0 110.36 165.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.9 p -150.41 163.29 24.73 Favored Pre-proline 0 CA--C 1.498 -1.028 0 O-C-N 119.375 -2.078 . . . . 1.0 112.556 -153.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -57.48 -33.86 97.07 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 123.857 3.038 . . . . 1.0 116.253 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.8 -44.75 69.42 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 122.499 1.143 . . . . 1.0 113.027 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.51 -43.96 79.61 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 124.839 1.255 . . . . 1.0 113.334 -178.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.3 tp -90.83 -8.42 49.62 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.901 -1.124 . . . . 1.0 112.58 -178.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 62.29 44.96 7.09 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 126.794 2.038 . . . . 1.0 114.532 -178.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.6 mtt -59.41 151.32 24.11 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 127.074 2.149 . . . . 1.0 112.868 171.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -120.58 177.76 4.94 Favored 'General case' 0 N--CA 1.432 -1.333 0 O-C-N 121.213 -0.93 . . . . 1.0 109.073 -170.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -56.74 -26.77 57.94 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 127.695 2.398 . . . . 1.0 115.426 -175.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -136.07 83.21 1.99 Allowed 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 123.872 0.869 . . . . 1.0 109.101 162.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.4 166.36 19.48 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 120.121 -1.612 . . . . 1.0 114.581 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 m -132.58 118.42 19.18 Favored 'General case' 0 CA--C 1.496 -1.13 0 C-N-CA 124.503 1.121 . . . . 1.0 110.925 173.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.7 mm -108.64 140.94 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 C-N-CA 129.502 3.121 . . . . 1.0 109.595 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -110.83 134.33 52.61 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 119.465 -2.022 . . . . 1.0 107.615 -164.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 t -110.95 126.71 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-O 121.643 0.735 . . . . 1.0 109.339 -173.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -116.43 143.08 46.02 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-O 122.201 1.0 . . . . 1.0 110.836 170.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -88.16 139.82 30.11 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.547 -1.346 . . . . 1.0 112.703 -175.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.434 -1.233 0 C-N-CA 124.385 1.074 . . . . 1.0 109.769 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 12.4 t . . . . . 0 N--CA 1.436 -1.162 0 CA-C-O 124.023 1.868 . . . . 1.0 111.57 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 967' ' ' ILE . . . . . 0.496 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 8.4 mt -113.13 124.81 70.14 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.27 0 C-N-CA 127.327 2.251 . . . . 1.0 111.13 -168.05 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -102.1 125.41 48.78 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 106.424 -1.695 . . . . 1.0 106.424 163.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.5 -0.951 0 N-CA-C 119.298 3.073 . . . . 1.0 119.298 -157.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.437 -1.119 0 N-CA-C 116.176 1.917 . . . . 1.0 116.176 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 37.0 pt -138.86 160.74 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 126.145 1.778 . . . . 1.0 108.556 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -117.76 144.91 44.87 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 119.179 -2.201 . . . . 1.0 108.035 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 34' ' ' ILE . 1.6 pt? -127.43 157.09 40.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 119.219 -2.175 . . . . 1.0 105.433 169.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -120.41 150.6 40.53 Favored 'General case' 0 N--CA 1.432 -1.369 0 O-C-N 119.498 -2.001 . . . . 1.0 111.482 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -118.44 122.1 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 N-CA-C 106.023 -1.843 . . . . 1.0 106.023 177.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.13 131.64 54.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.543 1.137 . . . . 1.0 111.631 -169.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.45 0 N-CA-C 109.465 -1.454 . . . . 1.0 109.465 177.034 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.433 -1.279 0 N-CA-C 111.563 0.209 . . . . 1.0 111.563 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.42 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.256 0.5 OUTLIER -129.14 138.68 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 O-C-N 120.355 -1.466 . . . . 1.0 110.88 168.35 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.01 144.98 46.23 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 124.911 2.291 . . . . 1.0 113.963 -175.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.405 ' CD2' HD13 ' B' ' 967' ' ' ILE . 0.3 OUTLIER -132.96 140.66 47.92 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.806 -1.809 . . . . 1.0 107.338 -165.655 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -108.47 118.51 36.96 Favored 'General case' 0 N--CA 1.434 -1.258 0 C-N-CA 126.415 1.886 . . . . 1.0 111.78 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.515 ' HB ' HD11 ' B' ' 969' ' ' LEU . 9.2 tt -147.91 154.73 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.351 0 CA-C-O 124.954 2.311 . . . . 1.0 110.646 -148.048 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -117.27 160.29 21.33 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 112.511 -2.131 . . . . 1.0 111.84 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -62.15 -38.13 87.83 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 117.4 2.37 . . . . 1.0 117.4 -159.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -74.49 -25.14 59.19 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.346 -1.471 . . . . 1.0 114.36 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.7 m -62.69 127.76 90.79 Favored Pre-proline 0 N--CA 1.436 -1.134 0 C-N-CA 125.885 1.674 . . . . 1.0 114.5 -172.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -69.81 158.47 56.79 Favored 'Trans proline' 0 N--CA 1.441 -1.582 0 C-N-CA 122.895 2.397 . . . . 1.0 113.986 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.439 2.8 pp -59.34 -25.48 64.24 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 114.565 1.32 . . . . 1.0 114.565 177.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 t -52.71 -29.03 24.55 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 120.154 -1.592 . . . . 1.0 113.738 171.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -43.28 88.38 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 119.959 -1.713 . . . . 1.0 113.24 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.43 HD13 ' H ' ' A' ' 43' ' ' LEU 0.421 0.0 OUTLIER -70.31 -31.22 68.45 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 171.169 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.6 tpp -60.22 -45.92 91.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 O-C-N 120.466 -1.396 . . . . 1.0 113.132 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -43.88 98.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 120.909 -1.12 . . . . 1.0 112.552 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.22 79.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.07 1.137 . . . . 1.0 114.07 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -62.7 -44.16 96.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 120.395 -1.44 . . . . 1.0 111.781 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.0 m -62.93 -41.86 99.62 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.731 1.213 . . . . 1.0 114.095 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -68.19 -51.32 47.02 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.984 -1.697 . . . . 1.0 114.868 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.406 ' HD2' HG23 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -72.63 -43.17 63.6 Favored 'General case' 0 CA--C 1.496 -1.116 0 O-C-N 120.049 -1.657 . . . . 1.0 113.749 -173.764 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -112.46 6.97 18.89 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 123.84 0.856 . . . . 1.0 113.036 -170.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.63 3.04 89.86 Favored Glycine 0 N--CA 1.437 -1.247 0 N-CA-C 118.631 2.212 . . . . 1.0 118.631 162.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.18 166.46 23.21 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.746 1.758 . . . . 1.0 115.746 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.1 m -102.25 129.42 48.65 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.549 -1.344 . . . . 1.0 110.455 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -66.55 -21.24 66.16 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 115.681 1.734 . . . . 1.0 115.681 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ptt-85 -77.85 -17.88 56.89 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.75 -1.219 . . . . 1.0 113.462 176.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -94.79 -16.82 22.68 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.392 1.077 . . . . 1.0 112.353 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.5 pt -119.98 141.2 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.2 0 C-N-CA 124.647 1.179 . . . . 1.0 110.251 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 154.94 49.04 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 107.001 -1.481 . . . . 1.0 107.001 171.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -113.2 148.67 34.99 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 122.302 1.049 . . . . 1.0 110.98 -171.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 41.2 ptt180 -137.51 158.15 45.01 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.753 -1.217 . . . . 1.0 111.525 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -137.52 121.2 17.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.51 -0.922 . . . . 1.0 108.51 174.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t70 56.4 40.35 29.74 Favored 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 126.223 1.809 . . . . 1.0 112.99 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.52 3.43 86.48 Favored Glycine 0 N--CA 1.438 -1.205 0 O-C-N 120.095 -1.628 . . . . 1.0 116.273 -176.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -116.65 139.76 25.93 Favored Pre-proline 0 N--CA 1.435 -1.189 0 CA-C-N 119.548 1.674 . . . . 1.0 110.493 -172.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.65 142.64 32.74 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.78 2.32 . . . . 1.0 112.84 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 pt -117.82 147.07 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 C-N-CA 125.439 1.496 . . . . 1.0 108.849 -178.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -109.18 160.58 15.97 Favored 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 120.755 -1.216 . . . . 1.0 110.849 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -69.84 -14.28 62.67 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 119.157 -2.214 . . . . 1.0 114.969 -177.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 95.8 m -99.34 0.46 42.95 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 124.849 1.26 . . . . 1.0 111.714 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -76.75 168.95 19.19 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 118.275 -2.766 . . . . 1.0 109.87 161.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 p -152.77 163.62 22.94 Favored Pre-proline 0 CA--C 1.497 -1.09 0 O-C-N 119.69 -1.881 . . . . 1.0 111.035 -155.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -58.4 -32.87 97.19 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 123.516 2.811 . . . . 1.0 115.781 167.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.82 -45.96 55.66 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 122.123 0.963 . . . . 1.0 112.57 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -66.86 -40.66 87.95 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 125.676 1.591 . . . . 1.0 113.423 -176.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -88.24 -8.34 55.41 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 121.123 -0.986 . . . . 1.0 112.272 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 62.88 48.21 4.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 126.501 1.92 . . . . 1.0 113.65 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.4 mtt -61.19 154.2 23.99 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.727 2.011 . . . . 1.0 112.792 170.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -114.26 -178.4 3.36 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 -172.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.39 10.2 p-10 -55.05 -26.61 38.69 Favored 'General case' 0 N--CA 1.435 -1.225 0 N-CA-C 116.654 2.094 . . . . 1.0 116.654 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -141.27 73.04 1.4 Allowed 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 125.469 1.508 . . . . 1.0 110.27 174.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.19 164.9 24.54 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 116.077 1.881 . . . . 1.0 116.077 -174.589 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.1 m -131.77 115.39 15.91 Favored 'General case' 0 CA--C 1.495 -1.149 0 C-N-CA 124.439 1.096 . . . . 1.0 111.361 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.4 mm -117.9 140.68 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 C-N-CA 126.84 2.056 . . . . 1.0 108.745 -175.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.92 145.7 37.87 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.139 -1.601 . . . . 1.0 110.02 -166.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.6 t -108.56 135.21 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 124.297 1.039 . . . . 1.0 109.014 -177.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -121.83 136.35 54.93 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 122.678 1.228 . . . . 1.0 109.637 164.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -87.93 132.56 34.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 124.268 1.027 . . . . 1.0 110.413 -173.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 96.8 mm-40 . . . . . 0 N--CA 1.433 -1.278 0 N-CA-C 115.593 1.701 . . . . 1.0 115.593 -168.802 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 966' ' ' VAL . . . . . 0.42 HG21 ' CG2' ' A' ' 30' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.434 -1.26 0 N-CA-C 113.964 1.098 . . . . 1.0 113.964 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 967' ' ' ILE . . . . . 0.43 HG22 HD23 ' B' ' 969' ' ' LEU . 4.7 mt -112.43 116.32 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-O 121.993 0.901 . . . . 1.0 109.715 -169.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.07 103.68 14.27 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 120.463 -1.398 . . . . 1.0 108.803 174.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.515 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.071 0 O-C-N 119.731 -1.856 . . . . 1.0 115.077 -171.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 p80 . . . . . 0 N--CA 1.431 -1.414 0 CA-C-O 122.454 1.121 . . . . 1.0 112.64 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.8 pt -133.4 160.74 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.296 0 C-N-CA 129.47 3.108 . . . . 1.0 106.173 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.0 m-20 -113.12 144.81 42.01 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 118.885 -2.385 . . . . 1.0 108.185 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.837 HD22 HG21 ' A' ' 34' ' ' ILE . 1.3 pt? -128.37 155.91 43.95 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 105.967 -1.864 . . . . 1.0 105.967 171.111 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.425 ' HD3' HG21 ' A' ' 29' ' ' VAL . 12.9 ptpt -123.87 150.6 44.42 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 120.495 -1.378 . . . . 1.0 111.968 172.198 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -118.93 119.25 60.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.178 0 N-CA-C 108.038 -1.097 . . . . 1.0 108.038 177.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.44 130.22 54.23 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 122.389 1.09 . . . . 1.0 113.268 -165.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.523 0 CA-C-O 122.882 1.268 . . . . 1.0 111.991 173.732 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.425 HG21 ' HD3' ' A' ' 21' ' ' LYS . 1.6 p . . . . . 0 N--CA 1.428 -1.546 0 N-CA-C 106.715 -1.587 . . . . 1.0 106.715 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.738 HG22 HG11 ' B' ' 966' ' ' VAL . 0.8 OUTLIER -121.4 133.34 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 O-C-N 120.931 -1.105 . . . . 1.0 109.027 170.761 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.417 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -99.3 160.84 13.98 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.54 3.067 . . . . 1.0 114.583 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -145.1 140.54 28.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.297 -2.127 . . . . 1.0 105.526 -175.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -100.22 117.77 35.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 C-N-CA 127.317 2.247 . . . . 1.0 107.657 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.837 HG21 HD22 ' A' ' 20' ' ' LEU . 12.3 tt -146.1 154.87 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.281 0 C-N-CA 127.937 2.495 . . . . 1.0 111.33 -151.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.73 167.54 13.34 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 113.595 -1.638 . . . . 1.0 113.705 -174.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -66.57 -38.21 86.59 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 116.989 2.218 . . . . 1.0 116.989 -162.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -87.11 -27.78 22.9 Favored 'General case' 0 CA--C 1.494 -1.175 0 O-C-N 120.2 -1.562 . . . . 1.0 111.226 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.6 m -57.75 111.99 4.19 Favored Pre-proline 0 N--CA 1.436 -1.13 0 C-N-CA 127.834 2.454 . . . . 1.0 113.686 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -67.47 163.19 35.75 Favored 'Trans proline' 0 N--CA 1.441 -1.607 0 C-N-CA 124.055 3.17 . . . . 1.0 116.081 -172.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.45 2.5 pp -64.74 -25.59 68.0 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.087 1.514 . . . . 1.0 115.087 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 97.3 p -52.68 -29.1 24.68 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.876 -1.765 . . . . 1.0 114.915 168.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.18 -43.92 80.96 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.214 -1.554 . . . . 1.0 112.094 -177.048 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.424 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -68.4 -35.59 77.88 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.555 -1.341 . . . . 1.0 113.568 171.635 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.3 ttm -60.59 -43.65 97.14 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.318 -1.488 . . . . 1.0 114.207 176.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -66.72 -39.44 88.02 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.517 -1.364 . . . . 1.0 112.971 174.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.91 82.66 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.249 -1.532 . . . . 1.0 114.392 177.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -58.54 -43.85 89.39 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 126.542 1.937 . . . . 1.0 110.863 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.9 m -62.01 -41.75 98.42 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 120.332 -1.48 . . . . 1.0 114.055 174.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -67.15 -47.71 70.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 114.707 1.373 . . . . 1.0 114.707 175.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -73.14 -43.25 61.89 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 115.892 1.812 . . . . 1.0 115.892 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -112.49 4.17 17.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 121.611 -0.68 . . . . 1.0 112.051 -164.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.49 24.37 47.03 Favored Glycine 0 CA--C 1.494 -1.272 0 N-CA-C 117.403 1.721 . . . . 1.0 117.403 159.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.3 mt -103.7 166.88 10.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 124.773 1.229 . . . . 1.0 112.733 -171.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.9 m -101.91 133.19 47.07 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 120.552 -1.342 . . . . 1.0 110.08 171.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 20.5 ptp -66.45 -25.42 66.72 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 115.499 1.666 . . . . 1.0 115.499 -170.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 -87.05 -1.62 58.01 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.281 -1.512 . . . . 1.0 112.783 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -102.82 -4.73 24.47 Favored 'General case' 0 N--CA 1.433 -1.297 0 O-C-N 120.893 -1.129 . . . . 1.0 111.792 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.6 pt -118.95 142.37 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 O-C-N 120.69 -1.256 . . . . 1.0 111.326 175.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -138.16 143.85 40.48 Favored 'General case' 0 N--CA 1.434 -1.268 0 O-C-N 120.246 -1.534 . . . . 1.0 107.542 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -105.65 145.16 31.39 Favored 'General case' 0 N--CA 1.433 -1.318 0 O-C-N 121.102 -0.999 . . . . 1.0 109.346 -175.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -120.84 152.61 38.18 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.462 1.125 . . . . 1.0 109.838 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -127.99 119.23 25.05 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.261 -1.755 . . . . 1.0 106.261 162.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.8 t70 52.68 45.99 27.59 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.075 1.35 . . . . 1.0 113.615 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.73 3.92 87.58 Favored Glycine 0 N--CA 1.435 -1.406 0 N-CA-C 117.823 1.889 . . . . 1.0 117.823 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -121.38 144.63 40.47 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 120.762 2.281 . . . . 1.0 109.039 176.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -68.04 149.65 77.17 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 122.785 2.03 . . . . 1.0 113.701 176.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.9 pt -116.84 141.97 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.258 0 N-CA-C 106.012 -1.847 . . . . 1.0 106.012 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -112.64 171.26 7.63 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 120.481 -1.387 . . . . 1.0 109.842 -162.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -73.53 -16.77 61.27 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.428 -2.045 . . . . 1.0 113.131 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.7 m -83.54 -13.88 53.51 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 125.15 1.38 . . . . 1.0 112.436 167.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -77.36 167.37 21.8 Favored 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.087 -2.258 . . . . 1.0 111.208 168.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.0 p -154.78 160.4 30.95 Favored Pre-proline 0 CA--C 1.496 -1.103 0 O-C-N 120.057 -1.652 . . . . 1.0 109.873 -160.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.1 -41.17 26.91 Favored 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 124.352 3.368 . . . . 1.0 116.328 161.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.09 88.1 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 114.489 1.292 . . . . 1.0 114.489 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -71.42 -38.4 71.4 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.323 1.449 . . . . 1.0 113.014 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 tp -94.57 -1.93 52.43 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 121.088 -1.008 . . . . 1.0 112.905 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 55.29 48.22 19.74 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 126.495 1.918 . . . . 1.0 114.915 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.6 mtt -62.2 144.12 55.89 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 126.136 1.774 . . . . 1.0 113.758 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -92.49 176.33 6.5 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 122.354 1.073 . . . . 1.0 112.473 -174.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.258 9.3 p-10 -56.57 -26.52 55.44 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 127.832 2.453 . . . . 1.0 115.144 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -138.39 75.36 1.52 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 125.185 1.394 . . . . 1.0 108.123 166.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.76 157.22 31.79 Favored 'General case' 0 N--CA 1.436 -1.145 0 O-C-N 119.668 -1.895 . . . . 1.0 113.696 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.9 m -125.62 115.25 19.84 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.905 0.86 . . . . 1.0 110.314 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.3 mm -122.02 140.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.172 0 C-N-CA 127.548 2.339 . . . . 1.0 108.747 -172.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -110.91 147.02 35.52 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.855 -1.778 . . . . 1.0 109.578 -163.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 59.8 t -108.53 129.33 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.22 0 O-C-N 121.002 -1.062 . . . . 1.0 109.865 -175.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -118.71 138.88 52.33 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 122.97 1.367 . . . . 1.0 110.701 163.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -87.19 142.37 27.96 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 121.15 -0.969 . . . . 1.0 112.764 -175.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.433 -1.315 0 O-C-N 121.199 -0.938 . . . . 1.0 110.785 -169.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 966' ' ' VAL . . . . . 0.738 HG11 HG22 ' A' ' 30' ' ' VAL . 31.1 t . . . . . 0 N--CA 1.436 -1.173 0 CA-C-O 122.035 0.922 . . . . 1.0 113.199 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 967' ' ' ILE . . . . . 0.46 HG13 HG12 ' B' ' 966' ' ' VAL . 1.2 mt -94.41 123.94 46.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 O-C-N 121.053 -1.029 . . . . 1.0 108.501 -159.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -101.98 107.1 18.13 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.183 -1.573 . . . . 1.0 107.033 172.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.461 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.3 pp . . . . . 0 N--CA 1.437 -1.077 0 O-C-N 120.219 -1.55 . . . . 1.0 112.824 -172.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.43 -1.432 0 CA-C-O 122.45 1.119 . . . . 1.0 113.098 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.6 pt -136.37 160.63 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 C-N-CA 128.53 2.732 . . . . 1.0 106.343 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -117.66 144.7 44.96 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 119.641 -1.912 . . . . 1.0 106.589 169.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.47 154.55 51.35 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.392 -1.443 . . . . 1.0 107.142 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -120.0 148.23 43.81 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.071 1.748 . . . . 1.0 111.354 175.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 t -119.98 122.93 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 N-CA-C 107.783 -1.192 . . . . 1.0 107.783 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.57 130.17 55.01 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 124.615 1.166 . . . . 1.0 111.883 -172.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.294 0 CA-C-O 122.746 1.192 . . . . 1.0 114.756 -177.658 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.436 -1.16 0 N-CA-C 113.421 0.897 . . . . 1.0 113.421 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -129.26 138.73 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.862 -1.774 . . . . 1.0 110.169 169.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.69 145.88 47.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-O 124.06 1.885 . . . . 1.0 113.77 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.83 141.7 44.73 Favored 'General case' 0 N--CA 1.432 -1.353 0 O-C-N 119.81 -1.806 . . . . 1.0 109.254 -166.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.272 26.7 ttpt -107.05 115.89 30.97 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.552 1.941 . . . . 1.0 113.483 -176.201 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.52 ' HB ' HD11 ' B' ' 969' ' ' LEU . 6.8 tt -148.86 154.62 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.429 0 CA-C-O 123.994 1.854 . . . . 1.0 109.833 -158.084 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.305 3.7 mppt? -95.89 165.76 12.12 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.316 -1.765 . . . . 1.0 112.48 -172.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.4 mtm180 -63.49 -38.07 89.72 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 115.847 1.795 . . . . 1.0 115.847 -160.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -85.43 -23.97 27.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.549 -1.344 . . . . 1.0 112.742 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.8 m -59.12 131.79 87.29 Favored Pre-proline 0 N--CA 1.436 -1.148 0 C-N-CA 126.972 2.109 . . . . 1.0 115.062 -169.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.02 162.05 41.61 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 124.097 3.198 . . . . 1.0 115.236 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.384 2.7 pp -66.91 -25.69 66.5 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 124.663 1.185 . . . . 1.0 114.178 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.4 p -52.74 -29.17 25.63 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 120.342 -1.474 . . . . 1.0 114.839 170.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.73 -43.53 65.69 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.212 -1.555 . . . . 1.0 112.32 -172.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.445 HD13 ' H ' ' A' ' 43' ' ' LEU 0.359 0.0 OUTLIER -68.09 -31.13 70.53 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.61 -1.306 . . . . 1.0 114.167 168.624 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 9.7 ttt -61.64 -43.43 98.88 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.535 -1.353 . . . . 1.0 114.001 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -67.47 -36.41 81.1 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 120.41 -1.431 . . . . 1.0 113.554 170.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.51 -34.89 77.78 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 119.411 -2.056 . . . . 1.0 114.323 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.6 -43.06 99.56 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 126.296 1.839 . . . . 1.0 111.914 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 75.4 m -61.51 -43.85 98.13 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.614 -1.304 . . . . 1.0 113.834 171.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -62.35 -51.84 66.02 Favored 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 120.6 -1.313 . . . . 1.0 114.442 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.444 ' HB2' HD11 ' B' ' 967' ' ' ILE . 0.0 OUTLIER -78.47 -43.33 27.39 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 115.132 1.53 . . . . 1.0 115.132 -176.82 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -108.77 4.22 23.43 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 121.206 -0.933 . . . . 1.0 111.448 -166.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.01 4.95 89.74 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 117.896 1.919 . . . . 1.0 117.896 161.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.7 mt -76.63 160.95 28.96 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.742 1.617 . . . . 1.0 113.833 -173.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 m -102.27 131.77 48.63 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 120.426 -1.421 . . . . 1.0 109.138 168.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.9 ptp -66.58 -18.54 65.42 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 116.427 2.01 . . . . 1.0 116.427 -173.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -85.61 -8.92 57.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 120.602 -1.312 . . . . 1.0 114.078 173.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -82.07 -33.25 29.96 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.634 -1.916 . . . . 1.0 112.453 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.6 pt -113.59 152.68 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 C-N-CA 125.279 1.431 . . . . 1.0 111.119 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -137.69 154.92 49.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 O-C-N 120.511 -1.368 . . . . 1.0 108.055 172.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 -111.3 148.56 32.66 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.662 1.22 . . . . 1.0 110.553 -173.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 53.3 mtm180 -130.26 159.28 37.36 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 122.165 0.983 . . . . 1.0 109.454 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -133.8 125.71 29.05 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 163.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 48.35 44.79 20.35 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 126.816 2.046 . . . . 1.0 114.416 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.98 6.83 86.32 Favored Glycine 0 N--CA 1.435 -1.424 0 O-C-N 120.146 -1.596 . . . . 1.0 116.785 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -119.94 148.28 46.27 Favored Pre-proline 0 N--CA 1.436 -1.13 0 CA-C-N 121.14 2.47 . . . . 1.0 109.288 175.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.11 149.72 52.73 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 122.588 2.192 . . . . 1.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.1 pt -120.57 140.41 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 N-CA-C 107.166 -1.42 . . . . 1.0 107.166 174.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.51 164.28 11.75 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.759 -1.213 . . . . 1.0 110.957 -168.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.9 -13.89 60.59 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 119.056 -2.277 . . . . 1.0 113.945 -176.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 m -96.7 1.45 51.01 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 124.6 1.16 . . . . 1.0 111.226 170.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -82.5 172.0 13.5 Favored 'General case' 0 N--CA 1.432 -1.325 0 O-C-N 119.098 -2.251 . . . . 1.0 110.211 171.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.5 p -147.98 162.19 32.02 Favored Pre-proline 0 CA--C 1.498 -1.053 0 O-C-N 119.684 -1.885 . . . . 1.0 112.384 -153.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -56.17 -33.62 90.95 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 123.587 2.858 . . . . 1.0 115.879 166.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.88 -45.96 69.63 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 119.573 1.078 . . . . 1.0 113.541 176.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.26 -38.64 71.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 125.638 1.575 . . . . 1.0 113.63 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -93.27 -8.47 42.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 121.014 -1.053 . . . . 1.0 111.669 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 63.87 43.22 5.51 Favored 'General case' 0 N--CA 1.435 -1.219 0 C-N-CA 126.878 2.071 . . . . 1.0 113.763 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.2 147.0 49.18 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.216 1.807 . . . . 1.0 111.825 175.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -120.41 176.33 5.54 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 108.712 -0.847 . . . . 1.0 108.712 -168.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.276 10.7 p-10 -54.79 -26.54 35.32 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.837 2.055 . . . . 1.0 115.272 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.07 77.19 1.69 Allowed 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.582 1.553 . . . . 1.0 110.073 166.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.69 160.91 22.29 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 119.656 -1.903 . . . . 1.0 114.823 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -133.59 115.57 14.85 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 124.808 1.243 . . . . 1.0 111.059 -178.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.6 mm -120.4 140.72 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.027 0 C-N-CA 127.817 2.447 . . . . 1.0 111.049 -171.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -110.86 137.41 48.55 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.92 -1.738 . . . . 1.0 109.907 -162.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.65 132.21 57.19 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.246 0 O-C-N 120.774 -1.204 . . . . 1.0 109.63 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -120.4 137.3 54.39 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-O 123.135 1.445 . . . . 1.0 110.223 159.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -96.85 120.4 37.11 Favored 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 120.671 -1.268 . . . . 1.0 110.357 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 . . . . . 0 N--CA 1.434 -1.268 0 O-C-N 121.124 -0.985 . . . . 1.0 111.831 -174.12 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.295 0.2 OUTLIER . . . . . 0 N--CA 1.436 -1.156 0 N-CA-C 115.234 1.568 . . . . 1.0 115.234 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 967' ' ' ILE . . . . . 0.444 HD11 ' HB2' ' A' ' 50' ' ' ARG . 6.3 mt -113.12 115.42 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 124.113 0.965 . . . . 1.0 109.699 -171.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -102.15 101.98 12.37 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.715 1.606 . . . . 1.0 110.897 172.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.52 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.439 -0.988 0 N-CA-C 118.922 2.934 . . . . 1.0 118.922 -168.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.4 p-80 . . . . . 0 N--CA 1.435 -1.181 0 N-CA-C 117.272 2.323 . . . . 1.0 117.272 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.2 pt -133.26 160.82 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.3 0 C-N-CA 128.732 2.813 . . . . 1.0 107.38 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -110.09 144.92 37.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 O-C-N 118.988 -2.32 . . . . 1.0 108.441 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.71 HD22 HG21 ' A' ' 34' ' ' ILE . 1.5 pt? -127.13 149.79 49.79 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.678 -1.889 . . . . 1.0 106.384 169.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -117.71 148.83 41.64 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 119.74 -1.85 . . . . 1.0 110.629 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.4 t -117.3 127.95 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.271 0 N-CA-C 107.127 -1.434 . . . . 1.0 107.127 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.69 130.13 55.67 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.2 1.0 . . . . 1.0 110.323 176.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.427 0 CA-C-O 123.093 1.385 . . . . 1.0 114.096 178.291 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 N--CA 1.437 -1.108 0 CA-C-O 121.502 0.668 . . . . 1.0 112.611 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.24 138.82 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.947 -1.72 . . . . 1.0 112.174 173.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.45 147.95 34.16 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-O 125.052 2.358 . . . . 1.0 115.488 175.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -132.95 140.62 47.91 Favored 'General case' 0 N--CA 1.432 -1.365 0 O-C-N 119.523 -1.985 . . . . 1.0 107.862 -170.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -104.56 118.96 37.88 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 126.318 1.847 . . . . 1.0 109.368 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.71 HG21 HD22 ' A' ' 20' ' ' LEU . 12.8 tt -148.46 154.81 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.317 0 CA-C-O 125.238 2.447 . . . . 1.0 111.537 -151.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -104.97 160.35 15.1 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 112.844 -1.98 . . . . 1.0 112.201 -176.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -61.74 -38.08 86.64 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 116.198 1.925 . . . . 1.0 116.198 -166.016 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -98.52 -9.8 24.45 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 119.982 -1.698 . . . . 1.0 113.654 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 88.9 m -62.05 121.68 67.29 Favored Pre-proline 0 N--CA 1.437 -1.101 0 C-N-CA 125.047 1.339 . . . . 1.0 111.402 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.59 160.23 44.53 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 CA-C-N 123.926 2.438 . . . . 1.0 114.309 -168.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.466 1.5 pp -61.45 -25.59 67.32 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 114.914 1.45 . . . . 1.0 114.914 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 99.0 p -52.77 -29.02 24.98 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.206 -1.559 . . . . 1.0 115.165 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.59 -46.98 67.91 Favored 'General case' 0 N--CA 1.437 -1.098 0 O-C-N 120.974 -1.079 . . . . 1.0 111.924 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.408 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -68.64 -31.5 70.69 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.667 -1.271 . . . . 1.0 112.914 174.605 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.6 ttp -59.82 -44.99 93.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.316 -1.49 . . . . 1.0 114.369 175.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -66.33 -38.44 87.68 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.778 -1.201 . . . . 1.0 112.697 174.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.96 -37.96 89.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 114.263 1.209 . . . . 1.0 114.263 174.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.01 -43.27 99.14 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 126.066 1.747 . . . . 1.0 111.902 174.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.3 m -62.17 -44.71 96.0 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.882 -1.136 . . . . 1.0 113.454 174.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -66.3 -49.52 66.78 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 114.17 1.174 . . . . 1.0 114.17 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -71.14 -43.29 67.87 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.04 -1.662 . . . . 1.0 115.285 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -115.32 6.35 14.88 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 121.077 -1.015 . . . . 1.0 112.929 -163.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.02 9.26 84.56 Favored Glycine 0 CA--C 1.493 -1.308 0 N-CA-C 117.153 1.621 . . . . 1.0 117.153 162.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.89 159.63 23.62 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.553 -1.557 . . . . 1.0 112.32 -175.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.3 m -102.33 134.02 46.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 O-C-N 121.1 -1.0 . . . . 1.0 110.146 172.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.7 ptp -66.26 -30.75 71.24 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 115.935 1.828 . . . . 1.0 115.935 -167.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt-85 -78.38 -15.04 59.1 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.348 -1.47 . . . . 1.0 113.455 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -92.07 -12.66 32.48 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.399 1.08 . . . . 1.0 111.756 -174.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -119.71 143.68 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.201 0 C-N-CA 124.34 1.056 . . . . 1.0 109.16 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -137.81 154.94 49.49 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.642 -1.286 . . . . 1.0 108.118 172.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -114.22 140.43 48.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 107.991 -1.115 . . . . 1.0 107.991 -162.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -129.67 149.54 51.38 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 120.822 -1.174 . . . . 1.0 109.191 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -123.53 112.31 17.32 Favored 'General case' 0 N--CA 1.433 -1.301 0 N-CA-C 107.81 -1.182 . . . . 1.0 107.81 160.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.6 t0 56.67 45.15 22.52 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 125.557 1.543 . . . . 1.0 113.974 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.94 1.44 84.88 Favored Glycine 0 N--CA 1.436 -1.309 0 N-CA-C 116.267 1.267 . . . . 1.0 116.267 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.61 125.81 31.87 Favored Pre-proline 0 N--CA 1.435 -1.223 0 CA-C-N 119.243 1.521 . . . . 1.0 108.994 -174.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -54.54 135.28 65.83 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.641 2.894 . . . . 1.0 115.79 169.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.8 pt -119.57 143.01 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -112.25 166.61 11.12 Favored 'General case' 0 CA--C 1.494 -1.2 0 O-C-N 120.407 -1.433 . . . . 1.0 110.995 -164.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -65.74 -21.49 66.52 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 119.825 -1.797 . . . . 1.0 114.755 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.1 m -82.89 -15.57 50.92 Favored 'General case' 0 N--CA 1.437 -1.109 0 C-N-CA 125.147 1.379 . . . . 1.0 112.959 171.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.8 168.75 19.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.217 -2.177 . . . . 1.0 112.637 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.1 p -148.63 158.81 39.65 Favored Pre-proline 0 CA--C 1.497 -1.08 0 O-C-N 120.179 -1.575 . . . . 1.0 110.68 -157.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -59.72 -30.91 93.25 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.18 2.586 . . . . 1.0 115.523 171.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.53 -46.03 74.01 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-O 122.035 0.921 . . . . 1.0 113.434 174.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -71.11 -42.56 69.13 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.717 1.207 . . . . 1.0 113.906 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.54 -8.54 58.88 Favored 'General case' 0 N--CA 1.435 -1.21 0 O-C-N 121.19 -0.944 . . . . 1.0 111.233 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 63.21 48.24 3.76 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 126.584 1.954 . . . . 1.0 112.983 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -64.67 148.55 50.77 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 127.201 2.201 . . . . 1.0 112.997 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -101.52 176.89 5.08 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 124.423 1.089 . . . . 1.0 110.069 -173.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.417 14.0 p-10 -60.48 -26.64 66.95 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 116.689 2.107 . . . . 1.0 116.689 -175.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -135.16 90.94 2.68 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.918 1.287 . . . . 1.0 108.442 157.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.51 163.57 22.59 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.845 -1.159 . . . . 1.0 114.013 -174.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.1 m -130.75 115.24 16.38 Favored 'General case' 0 CA--C 1.496 -1.098 0 O-C-N 121.307 -0.871 . . . . 1.0 110.337 177.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 47.1 mm -120.12 140.72 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 128.395 2.678 . . . . 1.0 109.452 -171.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -110.86 138.32 47.41 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 119.987 -1.696 . . . . 1.0 108.547 -164.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -115.56 133.53 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-O 122.789 1.28 . . . . 1.0 110.169 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -116.18 138.72 51.03 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 125.057 1.343 . . . . 1.0 110.218 169.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -89.11 137.21 32.53 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.884 -1.135 . . . . 1.0 111.874 -173.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 . . . . . 0 N--CA 1.435 -1.212 0 C-N-CA 125.499 1.52 . . . . 1.0 110.5 -178.851 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.277 0.2 OUTLIER . . . . . 0 CA--C 1.494 -1.18 0 N-CA-C 114.504 1.298 . . . . 1.0 114.504 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.2 mt -112.5 118.59 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 N-CA-C 108.39 -0.967 . . . . 1.0 108.39 -173.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -102.14 108.35 19.72 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 119.982 -1.698 . . . . 1.0 108.857 166.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 N--CA 1.437 -1.101 0 O-C-N 119.766 -1.834 . . . . 1.0 113.471 -170.559 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 . . . . . 0 N--CA 1.428 -1.541 0 N-CA-C 115.464 1.653 . . . . 1.0 115.464 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.5 pt -143.02 160.83 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 C-N-CA 130.917 3.687 . . . . 1.0 105.991 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -113.74 144.81 42.34 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 118.21 -2.806 . . . . 1.0 107.55 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.786 HD22 HG21 ' A' ' 34' ' ' ILE . 1.0 OUTLIER -133.8 156.6 47.73 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 119.327 -2.108 . . . . 1.0 105.975 173.801 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.38 150.64 50.65 Favored 'General case' 0 N--CA 1.434 -1.26 0 O-C-N 119.809 -1.807 . . . . 1.0 112.524 171.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.1 t -113.02 129.15 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.921 -1.511 . . . . 1.0 106.921 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 136.37 54.88 Favored 'General case' 0 N--CA 1.433 -1.324 0 C-N-CA 124.504 1.122 . . . . 1.0 112.453 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.494 -1.277 0 O-C-N 121.06 -1.025 . . . . 1.0 114.719 170.416 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t . . . . . 0 N--CA 1.434 -1.235 0 N-CA-C 107.421 -1.326 . . . . 1.0 107.421 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.541 ' CG2' HG11 ' B' ' 966' ' ' VAL . 1.1 p -129.16 138.02 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.101 0 O-C-N 121.325 -0.86 . . . . 1.0 111.204 174.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.41 ' HG3' HG23 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -100.98 160.07 14.68 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.829 3.204 . . . . 1.0 115.821 171.817 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -141.92 140.65 32.86 Favored 'General case' 0 N--CA 1.427 -1.61 0 O-C-N 118.954 -2.341 . . . . 1.0 105.174 -175.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.3 ttpt -101.39 117.32 34.7 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.336 -1.477 . . . . 1.0 107.618 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.786 HG21 HD22 ' A' ' 20' ' ' LEU . 6.4 tt -138.54 154.83 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-O 123.903 1.811 . . . . 1.0 110.09 -151.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -121.91 159.33 27.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.595 -1.639 . . . . 1.0 111.417 -177.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -71.23 -18.68 62.44 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 117.21 2.3 . . . . 1.0 117.21 -164.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 50.0 m80 -81.75 -28.64 33.22 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.925 -1.734 . . . . 1.0 112.481 167.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.4 m -66.88 116.16 32.45 Favored Pre-proline 0 N--CA 1.437 -1.088 0 N-CA-C 114.654 1.353 . . . . 1.0 114.654 -166.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.42 161.78 44.51 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 123.477 2.785 . . . . 1.0 115.099 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.454 3.0 pp -64.9 -25.63 67.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 114.582 1.327 . . . . 1.0 114.582 -178.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.5 p -52.85 -29.26 27.01 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 115.326 1.602 . . . . 1.0 115.326 167.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.19 -46.82 54.69 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.246 -1.534 . . . . 1.0 111.785 -171.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.761 HD13 ' H ' ' A' ' 43' ' ' LEU 0.337 0.0 OUTLIER -70.18 -31.29 68.69 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 113.995 1.109 . . . . 1.0 113.995 174.21 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.7 ttm -59.74 -45.85 90.95 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.413 -1.429 . . . . 1.0 113.797 170.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -65.15 -38.22 89.91 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.426 -1.421 . . . . 1.0 113.669 171.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.82 82.03 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 119.994 -1.691 . . . . 1.0 114.219 176.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.59 -41.13 94.08 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.695 1.998 . . . . 1.0 110.677 171.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 67.3 m -64.11 -43.51 95.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 120.66 -1.275 . . . . 1.0 113.812 172.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.93 -51.0 62.43 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.384 -1.448 . . . . 1.0 114.295 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -72.63 -43.21 63.53 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.365 -1.459 . . . . 1.0 114.77 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -116.26 12.26 15.34 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 121.799 0.809 . . . . 1.0 112.185 -162.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.38 10.8 85.59 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.411 1.325 . . . . 1.0 116.411 160.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.0 mt -80.48 159.95 25.41 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 124.887 1.275 . . . . 1.0 113.321 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 74.6 m -102.27 130.6 49.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.977 -1.077 . . . . 1.0 110.812 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.7 tpt -59.89 -38.27 81.76 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 116.298 1.962 . . . . 1.0 116.298 -165.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.422 ' NH1' HE22 ' A' ' 57' ' ' GLN . 7.7 ptm180 -94.71 1.68 55.51 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 120.705 -1.247 . . . . 1.0 111.993 -176.026 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.422 HE22 ' NH1' ' A' ' 56' ' ' ARG . 11.6 mp0 -102.17 -8.37 21.4 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 121.086 -1.008 . . . . 1.0 111.126 175.34 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 pt -116.83 138.12 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.215 0 O-C-N 120.483 -1.386 . . . . 1.0 109.34 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -138.18 154.96 49.12 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 106.675 -1.602 . . . . 1.0 106.675 173.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -115.88 148.74 39.65 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.994 1.378 . . . . 1.0 111.077 -169.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.8 ptt180 -136.31 150.16 48.76 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 121.083 -1.011 . . . . 1.0 109.57 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -124.74 109.05 12.63 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.166 -1.79 . . . . 1.0 106.166 173.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . 0.435 38.3 m-20 59.67 -127.04 1.18 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-O 116.721 -1.609 . . . . 1.0 110.826 -144.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.25 -16.2 53.35 Favored Glycine 0 CA--C 1.495 -1.158 3 C-N-CA 138.983 7.944 . . . . 1.0 118.565 7.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -123.6 129.47 24.84 Favored Pre-proline 0 N--CA 1.435 -1.19 0 CA-C-N 120.11 1.955 . . . . 1.0 109.142 160.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.26 135.19 66.56 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.703 2.269 . . . . 1.0 113.048 156.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.6 pt -117.64 138.68 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.16 0 CA-C-O 122.142 0.972 . . . . 1.0 108.481 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -112.72 165.99 11.77 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 121.188 -0.945 . . . . 1.0 109.841 -162.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -71.7 -13.83 61.85 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.745 -1.847 . . . . 1.0 113.719 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.5 m -90.23 -7.42 53.56 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 126.295 1.838 . . . . 1.0 111.728 169.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -82.38 165.07 20.61 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 118.387 -2.695 . . . . 1.0 110.661 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.7 p -151.22 164.38 20.44 Favored Pre-proline 0 CA--C 1.498 -1.022 0 O-C-N 120.523 -1.361 . . . . 1.0 110.656 -154.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -60.3 -36.0 89.35 Favored 'Trans proline' 0 N--CA 1.441 -1.599 0 C-N-CA 123.044 2.496 . . . . 1.0 113.999 171.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.18 80.58 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-O 122.57 1.176 . . . . 1.0 112.574 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -68.77 -45.18 72.04 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.453 1.101 . . . . 1.0 113.376 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.8 tp -89.48 -8.4 52.96 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 121.061 -1.024 . . . . 1.0 112.781 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.26 33.0 mt-10 64.35 44.06 4.42 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 127.802 2.441 . . . . 1.0 115.663 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.7 mtt -57.11 154.24 10.31 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 129.17 2.988 . . . . 1.0 113.771 173.156 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.439 ' HG3' ' H ' ' A' ' 80' ' ' ASP . 13.4 tp10 -142.19 -176.23 4.74 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 106.793 -1.558 . . . . 1.0 106.793 -172.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.439 ' H ' ' HG3' ' A' ' 79' ' ' GLU 0.312 0.9 OUTLIER -53.16 -26.54 17.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.084 2.954 . . . . 1.0 118.628 -165.968 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -140.36 56.36 1.6 Allowed 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 124.784 1.234 . . . . 1.0 110.528 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.45 162.31 25.81 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 119.608 -1.933 . . . . 1.0 116.057 -174.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.2 m -131.72 118.98 20.7 Favored 'General case' 0 CA--C 1.497 -1.088 0 O-C-N 120.968 -1.082 . . . . 1.0 111.795 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.3 mt -119.27 140.7 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 C-N-CA 126.495 1.918 . . . . 1.0 108.995 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.95 137.38 48.65 Favored 'General case' 0 N--CA 1.434 -1.253 0 O-C-N 120.289 -1.507 . . . . 1.0 108.026 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.1 p -108.58 136.75 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.146 0 O-C-N 120.509 -1.369 . . . . 1.0 109.946 -177.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -122.44 143.55 49.61 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.647 -1.283 . . . . 1.0 108.374 171.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -86.96 135.1 33.41 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.129 0.966 . . . . 1.0 112.15 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 . . . . . 0 N--CA 1.432 -1.333 0 C-N-CA 125.397 1.479 . . . . 1.0 109.675 -178.31 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 966' ' ' VAL . . . . . 0.541 HG11 ' CG2' ' A' ' 30' ' ' VAL . 9.5 t . . . . . 0 N--CA 1.437 -1.084 0 CA-C-O 121.663 0.744 . . . . 1.0 112.468 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 967' ' ' ILE . . . . . 0.403 ' H ' ' HB ' ' B' ' 966' ' ' VAL . 0.9 OUTLIER -86.51 130.39 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 O-C-N 120.433 -1.417 . . . . 1.0 110.437 -155.263 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -102.17 112.34 24.97 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.918 -1.739 . . . . 1.0 109.981 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 56.2 mt . . . . . 0 N--CA 1.437 -1.115 0 O-C-N 119.011 -2.306 . . . . 1.0 116.108 -174.492 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 68.1 m80 . . . . . 0 N--CA 1.433 -1.298 0 CA-C-O 121.768 0.794 . . . . 1.0 110.844 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.3 pt -143.02 160.84 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 130.488 3.515 . . . . 1.0 104.961 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -109.58 144.79 37.4 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 119.102 -2.249 . . . . 1.0 108.431 166.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.82 HD22 HG21 ' A' ' 34' ' ' ILE . 1.1 pt? -128.2 154.29 45.98 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.425 -2.047 . . . . 1.0 105.792 170.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 0.0 OUTLIER -124.07 150.68 44.7 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.701 -1.874 . . . . 1.0 111.756 169.803 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -110.9 136.78 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 O-C-N 121.166 -0.959 . . . . 1.0 108.64 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.17 130.15 53.58 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 124.494 1.118 . . . . 1.0 111.945 -174.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.381 0 CA-C-O 122.915 1.286 . . . . 1.0 113.999 -177.514 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p . . . . . 0 N--CA 1.434 -1.239 0 N-CA-C 109.077 -0.712 . . . . 1.0 109.077 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.423 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.311 0.3 OUTLIER -129.36 135.86 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.105 0 O-C-N 119.692 -1.88 . . . . 1.0 111.164 166.15 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.417 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -110.13 153.98 23.94 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 124.794 2.235 . . . . 1.0 114.377 175.64 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.5 140.53 37.24 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 106.477 -1.675 . . . . 1.0 106.477 -170.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -99.54 118.08 35.33 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.191 1.796 . . . . 1.0 107.084 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.82 HG21 HD22 ' A' ' 20' ' ' LEU . 8.7 tt -143.84 154.72 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.423 0 C-N-CA 126.595 1.958 . . . . 1.0 109.556 -154.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -116.55 161.16 19.57 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 113.172 -1.831 . . . . 1.0 112.399 -173.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -61.41 -38.02 85.59 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 125.329 1.452 . . . . 1.0 114.707 -164.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -101.08 14.5 31.76 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 124.373 1.069 . . . . 1.0 113.515 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.2 m -86.45 121.48 72.3 Favored Pre-proline 0 CA--C 1.497 -1.065 0 CA-C-O 116.703 -1.618 . . . . 1.0 109.367 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.31 158.95 41.99 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 CA-C-N 125.653 3.055 . . . . 1.0 115.534 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.403 1.3 pp -63.63 -25.57 68.28 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 125.302 1.441 . . . . 1.0 114.404 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -52.72 -29.11 25.05 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.501 -1.374 . . . . 1.0 114.222 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -42.69 68.86 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.442 -1.411 . . . . 1.0 111.524 -176.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.67 -37.14 84.17 Favored 'General case' 0 N--CA 1.434 -1.239 0 O-C-N 120.467 -1.396 . . . . 1.0 113.283 171.12 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.8 ttm -61.94 -42.63 99.33 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 119.83 -1.794 . . . . 1.0 113.872 175.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -43.57 98.45 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.746 1.26 . . . . 1.0 112.326 175.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.13 89.94 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 125.506 1.522 . . . . 1.0 113.837 177.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -61.03 -42.38 98.36 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 125.626 1.57 . . . . 1.0 111.561 172.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.2 m -63.57 -43.17 97.8 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.915 -1.116 . . . . 1.0 113.528 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.56 -48.78 63.37 Favored 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 124.36 1.064 . . . . 1.0 113.394 177.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -73.6 -43.02 60.76 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 116.537 2.051 . . . . 1.0 116.537 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -112.9 10.15 18.96 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.957 -1.089 . . . . 1.0 111.883 -165.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.0 43.17 10.05 Favored Glycine 0 CA--C 1.494 -1.246 0 N-CA-C 117.869 1.908 . . . . 1.0 117.869 160.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.5 mt -123.3 161.93 23.67 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 121.1 -1.235 . . . . 1.0 110.556 -168.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.8 m -102.23 133.21 47.48 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 120.137 -1.602 . . . . 1.0 111.084 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.5 tpt -58.68 -39.33 80.38 Favored 'General case' 0 N--CA 1.437 -1.112 0 N-CA-C 116.662 2.097 . . . . 1.0 116.662 -167.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -92.57 1.47 57.24 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.565 -1.334 . . . . 1.0 112.588 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -100.14 -21.82 15.41 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 124.486 1.114 . . . . 1.0 112.601 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.8 pt -112.95 149.66 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 124.252 1.021 . . . . 1.0 108.947 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.23 154.99 49.07 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.837 -1.164 . . . . 1.0 109.102 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -115.08 147.28 40.38 Favored 'General case' 0 N--CA 1.434 -1.243 0 O-C-N 120.934 -1.104 . . . . 1.0 110.613 -173.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 58.9 mtm180 -130.94 161.06 32.73 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 121.212 -0.93 . . . . 1.0 110.95 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -131.91 114.52 14.75 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.083 0.468 . . . . 1.0 109.99 164.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 t0 53.79 42.36 31.79 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 127.311 2.244 . . . . 1.0 114.066 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.95 0.78 83.27 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 124.978 1.275 . . . . 1.0 115.761 -176.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -99.9 137.6 20.18 Favored Pre-proline 0 N--CA 1.434 -1.242 0 O-C-N 120.337 -1.684 . . . . 1.0 109.53 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.97 137.66 24.57 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 CA-C-N 122.873 2.062 . . . . 1.0 112.127 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 19.4 pt -118.42 140.52 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.14 0 N-CA-C 106.011 -1.848 . . . . 1.0 106.011 177.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -106.64 161.52 14.57 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.163 -1.585 . . . . 1.0 109.711 -166.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -57.79 -34.97 70.19 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.403 -2.06 . . . . 1.0 115.532 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -78.55 -12.64 60.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.282 1.033 . . . . 1.0 113.145 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -74.04 170.52 15.27 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 119.475 -2.015 . . . . 1.0 111.66 177.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 63.9 p -148.02 162.31 31.51 Favored Pre-proline 0 CA--C 1.499 -0.992 0 O-C-N 119.065 -2.272 . . . . 1.0 112.746 -153.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_exo -55.04 -36.52 92.95 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 124.389 3.393 . . . . 1.0 115.857 163.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.55 -45.6 89.77 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 119.556 1.071 . . . . 1.0 113.639 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.61 -44.97 76.78 Favored 'General case' 0 N--CA 1.432 -1.345 0 C-N-CA 124.706 1.202 . . . . 1.0 112.624 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -90.6 -8.5 49.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 120.527 -1.358 . . . . 1.0 113.15 -176.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 69.48 37.79 1.91 Allowed 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 128.573 2.749 . . . . 1.0 114.675 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 52.5 mtt -58.19 152.76 16.4 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 128.326 2.65 . . . . 1.0 115.593 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.3 178.32 5.42 Favored 'General case' 0 N--CA 1.433 -1.307 0 O-C-N 121.139 -0.976 . . . . 1.0 109.666 -167.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.346 14.3 p-10 -54.38 -26.56 30.92 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 117.246 2.313 . . . . 1.0 117.246 -174.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -136.66 62.03 1.62 Allowed 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.52 1.528 . . . . 1.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.63 166.45 20.71 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 119.203 -2.186 . . . . 1.0 115.21 -177.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.7 m -133.56 121.56 22.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 O-C-N 121.04 -1.037 . . . . 1.0 110.7 -174.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.2 mm -118.67 140.71 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.103 0 C-N-CA 126.954 2.102 . . . . 1.0 109.327 -175.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -110.97 141.73 44.04 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.993 -1.692 . . . . 1.0 109.256 -167.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.1 t -108.49 128.97 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.181 0 CA-C-O 122.41 1.1 . . . . 1.0 109.842 -176.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -116.45 139.67 50.2 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 122.742 1.258 . . . . 1.0 111.159 173.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -96.84 120.32 36.96 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 121.254 -0.904 . . . . 1.0 111.81 -167.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 . . . . . 0 N--CA 1.435 -1.195 0 O-C-N 120.831 -1.168 . . . . 1.0 110.596 174.59 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 966' ' ' VAL . . . . . 0.423 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.27 0.2 OUTLIER . . . . . 0 N--CA 1.437 -1.114 0 N-CA-C 114.601 1.334 . . . . 1.0 114.601 . . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -108.68 116.57 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 N-CA-C 107.418 -1.327 . . . . 1.0 107.418 -172.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -102.21 110.66 22.68 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.918 -1.739 . . . . 1.0 106.671 167.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.445 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.5 pp . . . . . 0 CA--C 1.498 -1.057 0 O-C-N 120.048 -1.657 . . . . 1.0 113.621 -170.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.435 -1.195 0 N-CA-C 114.526 1.306 . . . . 1.0 114.526 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.2 pt -142.95 160.82 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.299 1 C-N-CA 131.893 4.077 . . . . 1.0 106.096 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -113.89 144.93 42.22 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 117.722 -3.111 . . . . 1.0 110.112 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 HG21 ' A' ' 34' ' ' ILE . 1.0 OUTLIER -129.95 148.51 51.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 119.036 -2.29 . . . . 1.0 107.689 171.207 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 8.6 ptpt -115.03 150.63 35.58 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 119.478 -2.014 . . . . 1.0 111.63 169.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.8 p -119.59 131.57 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 O-C-N 121.062 -1.023 . . . . 1.0 108.822 175.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.62 130.25 51.26 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 122.791 1.281 . . . . 1.0 112.654 -175.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.429 0 CA-C-O 123.328 1.516 . . . . 1.0 115.572 -177.614 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.437 -1.125 0 CA-C-O 121.71 0.767 . . . . 1.0 112.031 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -129.21 138.74 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 O-C-N 119.722 -1.861 . . . . 1.0 110.842 167.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -113.68 146.4 39.87 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-O 124.688 2.185 . . . . 1.0 114.138 176.103 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.54 140.62 49.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.827 -1.796 . . . . 1.0 107.591 -170.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -100.34 116.54 32.55 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 125.231 1.412 . . . . 1.0 109.491 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.693 HG21 HD22 ' A' ' 20' ' ' LEU . 11.3 tt -141.73 154.85 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.39 0 C-N-CA 128.167 2.587 . . . . 1.0 110.11 -152.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.55 164.28 14.54 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 112.974 -1.921 . . . . 1.0 112.448 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -67.28 -38.07 84.47 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 115.081 1.512 . . . . 1.0 115.081 -165.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -98.11 31.09 2.84 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 124.861 1.264 . . . . 1.0 112.08 174.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.4 m -114.65 111.68 45.99 Favored Pre-proline 0 N--CA 1.436 -1.153 0 O-C-N 120.585 -1.322 . . . . 1.0 107.596 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -62.04 160.17 31.18 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 123.98 3.12 . . . . 1.0 116.432 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.378 2.0 pp -63.89 -25.65 68.25 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 122.941 1.353 . . . . 1.0 114.15 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 t -52.51 -29.21 23.95 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 125.289 1.435 . . . . 1.0 113.896 169.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -66.75 -44.04 82.52 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.124 -1.61 . . . . 1.0 112.876 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.08 -32.2 70.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.493 -1.379 . . . . 1.0 113.101 174.052 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.0 ttm -60.59 -44.43 96.26 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 120.277 -1.514 . . . . 1.0 114.175 173.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -66.15 -38.25 87.67 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.566 -1.333 . . . . 1.0 113.339 172.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.93 85.31 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 120.179 -1.575 . . . . 1.0 114.048 175.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -62.55 -41.6 99.0 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 125.846 1.658 . . . . 1.0 112.257 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.5 -44.02 97.4 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 125.467 1.507 . . . . 1.0 113.014 171.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -64.9 -50.01 68.21 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.32 -1.487 . . . . 1.0 114.101 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -77.04 -43.34 34.92 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 115.345 1.609 . . . . 1.0 115.345 -177.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -113.44 -0.45 14.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.899 -1.125 . . . . 1.0 112.013 -165.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 2.69 89.15 Favored Glycine 0 CA--C 1.493 -1.283 0 N-CA-C 117.713 1.845 . . . . 1.0 117.713 164.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.45 153.21 37.74 Favored 'General case' 0 N--CA 1.433 -1.31 0 O-C-N 120.856 -1.379 . . . . 1.0 111.993 -170.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.2 m -99.32 127.73 45.37 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 120.724 -1.235 . . . . 1.0 109.442 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.6 ptp -66.53 -20.79 66.11 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.036 -1.665 . . . . 1.0 115.133 -174.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptt85 -75.75 -11.07 59.92 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 124.57 1.148 . . . . 1.0 114.019 170.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -109.38 -8.37 15.07 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.336 -1.477 . . . . 1.0 113.594 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.1 pt -128.49 150.19 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.16 0 O-C-N 120.128 -1.607 . . . . 1.0 109.99 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.24 150.0 46.29 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 107.959 -1.126 . . . . 1.0 107.959 170.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -108.38 144.58 35.76 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 121.206 -0.934 . . . . 1.0 109.676 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -134.13 159.1 41.9 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 122.48 1.133 . . . . 1.0 111.24 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -139.1 123.55 18.29 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 108.048 -1.094 . . . . 1.0 108.048 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 56.27 38.39 29.74 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 126.211 1.804 . . . . 1.0 113.351 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.28 2.73 84.42 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 116.287 1.275 . . . . 1.0 116.287 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -116.13 140.62 26.6 Favored Pre-proline 0 N--CA 1.435 -1.196 0 CA-C-N 120.094 1.947 . . . . 1.0 109.642 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -48.82 135.3 28.5 Favored 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 124.155 3.237 . . . . 1.0 117.245 169.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 pt -117.93 138.19 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.242 0 N-CA-C 106.329 -1.73 . . . . 1.0 106.329 169.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -104.12 167.14 9.95 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 121.096 -1.003 . . . . 1.0 109.887 -162.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -78.14 -16.54 57.85 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.032 -2.293 . . . . 1.0 111.259 -176.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.21 -13.83 59.45 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 130.959 3.703 . . . . 1.0 113.607 167.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -86.08 169.61 12.99 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 119.639 -1.913 . . . . 1.0 111.361 171.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.2 p -151.51 161.15 30.47 Favored Pre-proline 0 CA--C 1.496 -1.1 0 O-C-N 120.201 -1.562 . . . . 1.0 110.612 -158.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -58.42 -31.56 94.34 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 C-N-CA 123.846 3.031 . . . . 1.0 115.32 167.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.44 -46.07 74.2 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 119.544 1.065 . . . . 1.0 113.033 172.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -69.31 -37.73 77.91 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 124.499 1.12 . . . . 1.0 113.755 -176.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -95.18 -0.63 53.03 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 120.807 -1.183 . . . . 1.0 111.86 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 56.15 42.61 28.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 127.541 2.336 . . . . 1.0 115.86 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.8 mtt -59.84 149.42 31.41 Favored 'General case' 0 N--CA 1.434 -1.275 0 C-N-CA 127.126 2.17 . . . . 1.0 113.748 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -109.67 -172.38 2.03 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 121.358 -0.839 . . . . 1.0 109.113 -165.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.363 14.0 p-10 -60.21 -26.47 66.42 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.045 -1.659 . . . . 1.0 115.119 176.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -143.61 87.51 1.94 Allowed 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 124.416 1.087 . . . . 1.0 110.426 170.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.44 169.29 11.19 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 114.794 1.405 . . . . 1.0 114.794 178.273 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.3 m -136.45 123.13 21.06 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 124.874 1.269 . . . . 1.0 109.822 -175.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.8 mm -121.47 140.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 126.297 1.839 . . . . 1.0 108.883 -175.22 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -110.91 141.76 43.9 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.049 -1.657 . . . . 1.0 108.891 -171.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -108.59 139.63 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.142 0 O-C-N 120.522 -1.361 . . . . 1.0 109.542 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -124.45 137.46 54.44 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 122.206 1.003 . . . . 1.0 108.959 167.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -81.88 133.3 35.31 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.355 1.062 . . . . 1.0 112.228 -174.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 . . . . . 0 N--CA 1.435 -1.206 0 C-N-CA 124.972 1.309 . . . . 1.0 111.029 -174.985 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.272 0.2 OUTLIER . . . . . 0 CA--C 1.495 -1.137 0 N-CA-C 115.145 1.535 . . . . 1.0 115.145 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.1 mt -110.53 123.88 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 C-N-CA 124.218 1.007 . . . . 1.0 108.97 -170.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -102.14 105.63 16.36 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.52 -1.362 . . . . 1.0 108.294 165.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.9 pp . . . . . 0 N--CA 1.436 -1.171 0 O-C-N 120.624 -1.297 . . . . 1.0 113.022 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.435 -1.197 0 N-CA-C 116.295 1.961 . . . . 1.0 116.295 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.4 pt -138.06 160.78 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 129.132 2.973 . . . . 1.0 105.316 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -111.75 144.9 40.27 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.252 -2.155 . . . . 1.0 108.832 177.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.613 HD22 HG21 ' A' ' 34' ' ' ILE . 1.3 pt? -129.43 156.13 44.59 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 119.474 -2.016 . . . . 1.0 106.331 170.053 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.58 150.58 45.77 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 119.433 -2.042 . . . . 1.0 111.453 166.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 p -118.27 137.95 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 N-CA-C 108.377 -0.972 . . . . 1.0 108.377 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.88 130.2 49.71 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 121.356 -0.84 . . . . 1.0 112.498 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.364 0 CA-C-O 122.333 0.963 . . . . 1.0 114.587 -178.621 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 N--CA 1.434 -1.243 0 CA-C-O 121.89 0.852 . . . . 1.0 108.853 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.292 0.3 OUTLIER -129.42 138.75 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 O-C-N 120.4 -1.437 . . . . 1.0 111.717 173.791 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.06 149.91 39.52 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 124.058 1.885 . . . . 1.0 115.022 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.49 140.58 31.91 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.534 -1.354 . . . . 1.0 108.974 -162.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -104.22 115.84 31.12 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 125.283 1.433 . . . . 1.0 113.172 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.613 HG21 HD22 ' A' ' 20' ' ' LEU . 13.5 tt -141.32 154.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-O 124.614 2.15 . . . . 1.0 111.576 -154.149 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -93.7 153.98 18.05 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 112.272 -2.24 . . . . 1.0 113.504 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 68.9 mtt-85 -69.8 -38.17 76.55 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 115.783 1.772 . . . . 1.0 115.783 -172.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 30.3 t-80 -101.43 33.99 2.74 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.29 -1.506 . . . . 1.0 112.367 -174.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.32 155.11 80.54 Favored Pre-proline 0 CA--C 1.496 -1.114 0 O-C-N 120.601 -1.312 . . . . 1.0 108.119 -173.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -78.12 149.85 25.69 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 CA-C-N 124.241 2.55 . . . . 1.0 114.351 -167.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.336 2.1 pp -61.02 -25.53 66.98 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 125.876 1.67 . . . . 1.0 114.512 172.254 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 92.3 p -52.7 -29.04 24.54 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 119.366 -2.083 . . . . 1.0 113.823 171.488 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -65.33 -40.88 94.27 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.632 -1.293 . . . . 1.0 112.74 -174.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.9 -37.73 84.93 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.609 -1.307 . . . . 1.0 113.686 167.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 54.7 ttm -60.81 -42.12 97.04 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.097 -1.627 . . . . 1.0 113.908 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.83 -43.33 99.09 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.909 -1.119 . . . . 1.0 112.395 174.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.41 83.82 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.528 -1.358 . . . . 1.0 114.477 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -60.2 -42.76 95.76 Favored 'General case' 0 N--CA 1.436 -1.161 0 C-N-CA 125.959 1.704 . . . . 1.0 112.033 174.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.4 m -62.15 -41.65 98.49 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 124.793 1.237 . . . . 1.0 113.791 176.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.99 -47.29 75.04 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 114.289 1.218 . . . . 1.0 114.289 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -75.86 -42.99 47.81 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 116.185 1.92 . . . . 1.0 116.185 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -114.07 11.89 17.78 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.868 -1.145 . . . . 1.0 112.551 -161.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.34 43.71 19.43 Favored Glycine 0 CA--C 1.494 -1.244 0 N-CA-C 117.078 1.591 . . . . 1.0 117.078 164.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.4 mt -124.63 156.5 37.4 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 124.334 1.054 . . . . 1.0 111.154 -169.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.5 m -102.2 131.35 48.79 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.543 -1.348 . . . . 1.0 111.01 170.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -65.02 -24.5 67.52 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 116.317 1.969 . . . . 1.0 116.317 -170.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -89.69 -3.46 58.21 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.258 -1.526 . . . . 1.0 112.848 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -100.87 -15.91 17.42 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.715 -1.241 . . . . 1.0 111.849 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.2 pt -114.42 147.09 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 C-N-CA 125.312 1.445 . . . . 1.0 108.322 174.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -137.75 152.22 48.98 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.154 -1.424 . . . . 1.0 107.154 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.8 m-30 -109.4 148.59 30.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-O 123.079 1.418 . . . . 1.0 109.956 -173.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -139.62 140.97 37.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 108.023 -1.103 . . . . 1.0 108.023 -168.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -127.01 115.96 20.02 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.12 -1.437 . . . . 1.0 107.12 171.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t70 59.16 40.11 22.14 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 125.48 1.512 . . . . 1.0 114.117 171.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.71 5.17 90.15 Favored Glycine 0 N--CA 1.438 -1.216 0 N-CA-C 116.173 1.229 . . . . 1.0 116.173 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -117.17 136.67 23.45 Favored Pre-proline 0 N--CA 1.433 -1.278 0 O-C-N 120.291 -1.711 . . . . 1.0 109.97 -173.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -58.51 137.46 80.44 Favored 'Trans proline' 0 N--CA 1.44 -1.631 0 C-N-CA 123.539 2.826 . . . . 1.0 114.558 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.0 pt -117.13 135.68 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 N-CA-C 106.206 -1.776 . . . . 1.0 106.206 171.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -100.59 163.9 12.14 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.363 -1.461 . . . . 1.0 110.232 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.87 -17.55 61.52 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 119.053 -2.279 . . . . 1.0 113.598 -178.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 98.9 m -78.6 -19.78 51.96 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 125.665 1.586 . . . . 1.0 112.53 167.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -76.61 170.7 15.93 Favored 'General case' 0 N--CA 1.432 -1.355 0 O-C-N 119.702 -1.874 . . . . 1.0 112.153 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 77.2 p -149.25 159.07 37.7 Favored Pre-proline 0 CA--C 1.495 -1.154 0 O-C-N 119.861 -1.775 . . . . 1.0 109.556 -158.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -58.04 -35.05 99.04 Favored 'Trans proline' 0 N--CA 1.439 -1.69 0 C-N-CA 123.334 2.689 . . . . 1.0 114.94 168.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.97 83.26 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 113.916 1.08 . . . . 1.0 113.916 176.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -68.94 -42.52 76.62 Favored 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 124.845 1.258 . . . . 1.0 113.56 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -86.01 -8.47 57.93 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 121.926 0.87 . . . . 1.0 111.073 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 66.7 44.35 2.21 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 127.196 2.199 . . . . 1.0 114.259 175.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 60.3 mtt -62.05 154.24 27.38 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 128.598 2.759 . . . . 1.0 113.398 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -113.3 178.23 4.35 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 107.981 -1.118 . . . . 1.0 107.981 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.459 10.2 p-10 -54.23 -26.5 28.9 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 117.164 2.283 . . . . 1.0 117.164 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -138.28 58.5 1.67 Allowed 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 125.887 1.675 . . . . 1.0 112.069 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.89 161.61 29.59 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 116.233 1.938 . . . . 1.0 116.233 -171.393 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 61.2 m -129.04 116.42 19.28 Favored 'General case' 0 CA--C 1.497 -1.065 0 C-N-CA 125.011 1.325 . . . . 1.0 111.971 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.7 mm -120.74 140.91 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 C-N-CA 127.974 2.51 . . . . 1.0 109.842 -170.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -110.93 143.86 40.91 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 119.528 -1.983 . . . . 1.0 108.918 -167.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.4 t -108.66 126.25 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.214 0 O-C-N 120.955 -1.091 . . . . 1.0 108.762 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -113.6 134.84 54.48 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 123.403 1.573 . . . . 1.0 107.543 172.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -106.33 124.65 49.92 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.923 -1.111 . . . . 1.0 110.751 -161.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 . . . . . 0 N--CA 1.436 -1.157 0 O-C-N 120.777 -1.202 . . . . 1.0 112.597 -174.646 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.495 -1.17 0 N-CA-C 115.285 1.587 . . . . 1.0 115.285 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.4 mt -113.08 119.01 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 C-N-CA 125.11 1.364 . . . . 1.0 110.18 -173.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -102.02 115.65 31.0 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.06 -1.65 . . . . 1.0 106.808 165.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.072 0 CA-C-N 121.667 2.031 . . . . 1.0 114.581 -174.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 p80 . . . . . 0 N--CA 1.436 -1.129 0 N-CA-C 117.141 2.274 . . . . 1.0 117.141 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.3 pt -129.57 160.66 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 129.346 3.058 . . . . 1.0 106.153 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.75 144.79 44.98 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.925 -2.985 . . . . 1.0 111.027 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.65 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -131.52 151.38 51.63 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.286 -2.134 . . . . 1.0 107.992 170.391 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 7.5 ptpt -121.38 150.61 41.23 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 119.908 -1.745 . . . . 1.0 110.697 172.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.52 131.9 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 N-CA-C 108.314 -0.995 . . . . 1.0 108.314 174.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.75 132.43 54.61 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 124.759 1.224 . . . . 1.0 111.027 -174.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.49 0 N-CA-C 109.236 -1.546 . . . . 1.0 109.236 176.793 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.436 -1.143 0 N-CA-C 109.501 -0.555 . . . . 1.0 109.501 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.401 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.292 0.3 OUTLIER -129.31 138.72 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 O-C-N 119.846 -1.784 . . . . 1.0 111.208 166.4 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.407 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -116.31 147.21 41.77 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-O 125.393 2.521 . . . . 1.0 114.425 176.921 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -127.23 140.58 52.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.331 -1.729 . . . . 1.0 106.331 -173.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -101.23 115.85 31.44 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.835 2.454 . . . . 1.0 107.164 176.257 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.65 HG21 HD22 ' A' ' 20' ' ' LEU . 9.6 tt -137.7 154.72 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 CA-C-O 125.57 2.605 . . . . 1.0 109.362 -155.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 mtpp -108.74 164.16 12.62 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 110.967 -2.833 . . . . 1.0 111.775 -165.007 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -59.41 -38.01 79.53 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.989 1.848 . . . . 1.0 115.989 -160.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 -116.65 33.73 5.43 Favored 'General case' 0 N--CA 1.432 -1.35 0 O-C-N 120.958 -1.089 . . . . 1.0 111.759 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.8 m -90.77 124.85 61.1 Favored Pre-proline 0 N--CA 1.438 -1.072 0 O-C-N 120.654 -1.279 . . . . 1.0 109.938 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.73 159.82 52.02 Favored 'Trans proline' 0 N--CA 1.441 -1.615 0 C-N-CA 122.988 2.459 . . . . 1.0 114.615 175.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.359 1.0 OUTLIER -64.99 -25.79 68.01 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 114.805 1.409 . . . . 1.0 114.805 179.841 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.8 p -52.77 -29.24 26.18 Favored 'General case' 0 N--CA 1.437 -1.108 0 O-C-N 120.097 -1.627 . . . . 1.0 115.379 168.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.04 -42.9 68.9 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.042 -1.661 . . . . 1.0 112.572 -175.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.429 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -65.77 -35.68 81.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.67 -1.269 . . . . 1.0 113.527 172.985 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.9 ttm -61.75 -43.1 99.51 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 120.233 -1.542 . . . . 1.0 113.771 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -42.75 99.3 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 120.926 -1.108 . . . . 1.0 112.969 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.2 86.79 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.515 1.126 . . . . 1.0 113.759 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.38 -42.59 98.96 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.574 1.55 . . . . 1.0 112.212 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.2 m -61.88 -43.69 98.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.528 1.131 . . . . 1.0 113.525 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.58 -48.66 68.89 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.667 1.358 . . . . 1.0 114.667 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.1 -43.18 62.1 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 119.886 -1.759 . . . . 1.0 115.558 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -113.58 8.95 17.85 Favored 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 121.129 -0.982 . . . . 1.0 112.389 -165.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.63 9.84 85.11 Favored Glycine 0 CA--C 1.494 -1.267 0 N-CA-C 116.815 1.486 . . . . 1.0 116.815 162.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.7 mt -81.61 166.34 20.29 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 125.323 1.449 . . . . 1.0 113.238 -174.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -102.21 139.64 37.56 Favored 'General case' 0 CA--C 1.494 -1.21 0 O-C-N 120.563 -1.336 . . . . 1.0 112.245 170.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -29.25 70.63 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.1 1.36 . . . . 1.0 113.484 -178.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.6 ptt180 -95.0 -6.94 41.15 Favored 'General case' 0 N--CA 1.433 -1.291 0 C-N-CA 124.185 0.994 . . . . 1.0 112.771 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -94.6 -22.53 18.12 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.185 -1.572 . . . . 1.0 111.065 174.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 18.9 pt -110.2 145.03 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 CA-C-O 121.475 0.655 . . . . 1.0 112.368 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -138.17 154.95 49.13 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.403 -1.436 . . . . 1.0 109.176 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -115.41 148.67 39.08 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.502 -1.373 . . . . 1.0 112.803 -169.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.75 151.82 48.52 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 126.686 1.994 . . . . 1.0 109.133 175.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -130.84 116.19 17.6 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 108.797 -0.816 . . . . 1.0 108.797 167.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 37.5 t0 55.08 44.07 28.62 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 125.385 1.474 . . . . 1.0 113.31 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.79 2.43 81.36 Favored Glycine 0 N--CA 1.437 -1.288 0 O-C-N 120.314 -1.491 . . . . 1.0 115.924 -177.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -108.93 128.78 24.85 Favored Pre-proline 0 N--CA 1.435 -1.194 0 O-C-N 120.498 -1.59 . . . . 1.0 109.779 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -53.06 135.3 58.73 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 123.469 2.779 . . . . 1.0 116.435 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 pt -119.98 141.4 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.249 -1.389 . . . . 1.0 107.249 174.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.76 160.46 16.71 Favored 'General case' 0 N--CA 1.435 -1.224 0 O-C-N 120.727 -1.233 . . . . 1.0 109.182 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.77 -30.07 70.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 119.82 -1.8 . . . . 1.0 114.14 -173.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.1 m -96.58 6.25 49.1 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.36 1.464 . . . . 1.0 112.489 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -71.2 178.84 3.11 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 118.411 -2.68 . . . . 1.0 113.205 173.096 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.0 p -120.79 151.96 55.32 Favored Pre-proline 0 CA--C 1.498 -1.019 0 O-C-N 120.151 -1.593 . . . . 1.0 113.557 -161.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -56.4 -30.83 83.14 Favored 'Trans proline' 0 N--CA 1.442 -1.5 0 C-N-CA 123.806 3.004 . . . . 1.0 116.637 170.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.99 87.97 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 114.141 1.163 . . . . 1.0 114.141 173.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.21 -36.76 82.37 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 126.414 1.886 . . . . 1.0 112.793 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.657 HD11 HD12 ' A' ' 84' ' ' ILE . 62.3 tp -81.6 -8.49 59.72 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-O 122.795 1.283 . . . . 1.0 111.399 178.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 56.58 48.26 16.93 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 127.048 2.139 . . . . 1.0 113.376 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 93.7 mtp -62.19 143.48 56.72 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 115.73 1.752 . . . . 1.0 115.73 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -148.57 179.65 7.65 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 106.103 -1.814 . . . . 1.0 106.103 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.284 2.2 p30 -54.86 -26.57 36.38 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 116.655 2.094 . . . . 1.0 116.655 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -135.19 105.19 6.2 Favored 'General case' 0 N--CA 1.436 -1.166 0 C-N-CA 125.446 1.498 . . . . 1.0 108.219 162.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.439 ' HB3' ' HB2' ' A' ' 20' ' ' LEU . 5.0 t0 -100.18 158.73 15.65 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.714 -1.241 . . . . 1.0 112.135 164.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.4 m -136.35 115.29 12.25 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 124.251 1.02 . . . . 1.0 110.57 -176.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.657 HD12 HD11 ' A' ' 76' ' ' LEU . 10.0 mm -120.32 140.81 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.962 2.505 . . . . 1.0 109.219 -166.114 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -110.79 142.27 43.0 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 119.072 -2.268 . . . . 1.0 108.425 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.7 p -120.38 136.71 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.172 0 C-N-CA 125.114 1.366 . . . . 1.0 109.305 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -133.74 145.13 49.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 124.438 1.095 . . . . 1.0 108.067 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -105.83 132.59 51.76 Favored 'General case' 0 N--CA 1.433 -1.278 0 O-C-N 120.551 -1.343 . . . . 1.0 113.28 -169.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 . . . . . 0 N--CA 1.435 -1.193 0 C-N-CA 124.974 1.31 . . . . 1.0 112.755 -173.752 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 966' ' ' VAL . . . . . 0.401 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.333 0.2 OUTLIER . . . . . 0 N--CA 1.434 -1.25 0 N-CA-C 116.143 1.905 . . . . 1.0 116.143 . . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -112.37 113.47 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 O-C-N 121.51 -0.743 . . . . 1.0 109.495 -168.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.04 122.45 44.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.662 -1.899 . . . . 1.0 109.667 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 66.8 mt . . . . . 0 N--CA 1.437 -1.096 0 N-CA-C 115.748 1.758 . . . . 1.0 115.748 -172.099 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 . . . . . 0 N--CA 1.432 -1.357 0 CA-C-O 121.946 0.879 . . . . 1.0 108.957 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.6 pt -138.19 160.72 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 C-N-CA 129.975 3.31 . . . . 1.0 106.198 -171.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -117.89 144.89 45.04 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 119.353 -2.092 . . . . 1.0 110.712 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.685 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -134.03 160.83 36.56 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 118.761 -2.462 . . . . 1.0 108.334 173.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -131.7 150.66 52.08 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 119.985 -1.697 . . . . 1.0 112.914 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.477 HG22 ' HB ' ' A' ' 84' ' ' ILE . 47.0 t -119.12 119.28 60.35 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 N-CA-C 107.407 -1.331 . . . . 1.0 107.407 176.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -113.55 130.14 56.42 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.79 0.805 . . . . 1.0 111.918 -170.296 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.502 0 CA-C-O 122.948 1.305 . . . . 1.0 115.32 -175.141 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.9 p . . . . . 0 N--CA 1.434 -1.237 0 N-CA-C 110.176 -0.305 . . . . 1.0 110.176 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.72 HG22 HG11 ' B' ' 966' ' ' VAL . 0.9 OUTLIER -119.23 138.74 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.119 0 O-C-N 120.868 -1.145 . . . . 1.0 108.983 174.13 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.435 ' H ' HG21 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -112.68 160.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 126.729 3.157 . . . . 1.0 114.42 179.934 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.437 ' HB2' HD23 ' A' ' 20' ' ' LEU . 8.3 m-85 -145.1 140.64 28.18 Favored 'General case' 0 N--CA 1.428 -1.548 0 O-C-N 118.838 -2.414 . . . . 1.0 107.883 -165.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.277 30.0 ttpt -104.98 115.89 31.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.315 2.246 . . . . 1.0 113.994 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.685 HG21 HD22 ' A' ' 20' ' ' LEU . 6.3 tt -142.67 154.67 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.356 0 CA-C-O 124.007 1.86 . . . . 1.0 110.612 -154.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.266 3.7 mppt? -107.19 165.79 11.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 113.843 -1.526 . . . . 1.0 113.668 -175.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -63.28 -38.05 89.66 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 -160.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -99.14 -4.07 33.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.607 -1.308 . . . . 1.0 112.498 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 m -60.45 134.41 91.34 Favored Pre-proline 0 N--CA 1.437 -1.123 0 C-N-CA 126.294 1.838 . . . . 1.0 113.576 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.73 160.73 37.47 Favored 'Trans proline' 0 N--CA 1.441 -1.6 0 C-N-CA 122.867 2.378 . . . . 1.0 113.712 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.375 1.0 OUTLIER -65.58 -25.56 67.46 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 126.101 1.76 . . . . 1.0 114.066 178.613 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.2 p -52.8 -29.02 25.21 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 115.822 1.786 . . . . 1.0 115.822 173.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -65.39 -43.79 89.58 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 119.962 1.256 . . . . 1.0 114.079 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.545 HD22 HD21 ' A' ' 20' ' ' LEU . 0.5 OUTLIER -69.69 -31.06 68.88 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.052 -1.655 . . . . 1.0 112.693 177.672 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 tpp -60.43 -43.57 96.66 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 120.703 -1.248 . . . . 1.0 113.7 171.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -61.57 -43.35 99.03 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.696 -1.252 . . . . 1.0 113.381 171.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.38 -34.04 73.94 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.739 -1.85 . . . . 1.0 114.147 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.4 -36.88 79.15 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 127.217 2.207 . . . . 1.0 111.56 170.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 53' ' ' LEU . 77.7 m -69.9 -30.76 68.26 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 127.454 2.302 . . . . 1.0 113.671 170.448 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -67.07 -52.65 39.45 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 119.12 -2.237 . . . . 1.0 113.386 165.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -78.92 -43.44 24.75 Favored 'General case' 0 N--CA 1.437 -1.117 1 N-CA-C 125.339 5.311 . . . . 1.0 125.339 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -160.98 -18.03 0.05 Allowed 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 119.955 3.317 . . . . 1.0 119.955 -157.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.27 -37.56 4.29 Favored Glycine 0 CA--C 1.492 -1.375 0 O-C-N 118.55 -2.594 . . . . 1.0 110.83 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.461 ' HA ' ' HA ' ' A' ' 48' ' ' CYS 0.884 0.1 OUTLIER 57.16 -28.49 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.397 2 N-CA-C 128.003 6.297 . . . . 1.0 128.003 161.769 . . . . . . . . 5 4 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.8 m -102.4 123.65 46.55 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 105.94 -1.874 . . . . 1.0 105.94 154.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -63.76 -18.52 64.15 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.689 -1.257 . . . . 1.0 112.564 169.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -90.86 -3.52 57.3 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 113.307 0.855 . . . . 1.0 113.307 174.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -82.07 -38.54 24.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 120.009 -1.682 . . . . 1.0 112.527 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.6 pp -128.03 141.95 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.125 0 O-C-N 121.295 -0.878 . . . . 1.0 112.959 -165.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 155.06 48.98 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.549 1.539 . . . . 1.0 108.738 174.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -106.13 144.96 32.1 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.677 -1.264 . . . . 1.0 112.578 -168.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -126.39 145.18 50.56 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 126.284 1.834 . . . . 1.0 112.771 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -116.38 111.74 20.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.657 1.183 . . . . 1.0 108.549 168.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 t70 48.06 50.39 16.06 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 126.72 2.008 . . . . 1.0 114.574 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.73 0.89 89.9 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 117.544 1.778 . . . . 1.0 117.544 -178.047 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -118.3 133.46 23.49 Favored Pre-proline 0 N--CA 1.435 -1.206 0 CA-C-N 120.549 2.175 . . . . 1.0 110.528 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_exo -48.0 135.22 23.87 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 124.424 3.416 . . . . 1.0 117.55 168.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.6 pt -116.58 154.97 18.13 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 C-N-CA 124.826 1.251 . . . . 1.0 107.849 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -103.33 160.49 14.64 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.927 -1.108 . . . . 1.0 110.096 -175.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -63.18 -28.2 69.89 Favored 'General case' 0 CA--C 1.496 -1.106 0 O-C-N 119.554 -1.966 . . . . 1.0 114.04 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.3 m -92.29 -0.26 57.41 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 120.98 -1.075 . . . . 1.0 112.022 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -67.84 174.59 3.55 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.489 -2.007 . . . . 1.0 113.54 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.6 p -111.01 150.52 42.03 Favored Pre-proline 0 N--CA 1.438 -1.069 0 O-C-N 120.275 -1.515 . . . . 1.0 112.32 -156.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -58.01 -32.98 96.66 Favored 'Trans proline' 0 N--CA 1.44 -1.62 0 C-N-CA 122.959 2.439 . . . . 1.0 115.585 170.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.79 -45.37 82.65 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -66.66 -34.36 77.69 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.755 1.622 . . . . 1.0 113.595 -177.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 42.3 tp -95.33 -5.15 44.12 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.951 1.701 . . . . 1.0 112.023 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 59.47 45.33 13.71 Favored 'General case' 0 N--CA 1.436 -1.131 0 C-N-CA 127.468 2.307 . . . . 1.0 114.817 175.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.0 mtp -65.76 135.96 55.6 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 116.503 2.038 . . . . 1.0 116.503 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -150.48 -173.77 4.56 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.66 1.584 . . . . 1.0 108.516 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -55.77 -26.72 47.25 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 118.157 2.651 . . . . 1.0 118.157 -172.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -141.49 83.15 1.85 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.747 1.219 . . . . 1.0 108.311 167.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -85.59 159.6 19.83 Favored 'General case' 0 CA--C 1.498 -1.058 0 O-C-N 120.667 -1.271 . . . . 1.0 112.538 175.542 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -127.59 128.2 45.16 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 124.481 1.112 . . . . 1.0 109.843 174.106 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.477 ' HB ' HG22 ' A' ' 22' ' ' VAL . 77.1 mt -118.31 140.78 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 129.256 3.022 . . . . 1.0 106.605 178.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -110.75 145.51 37.96 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 119.526 -1.984 . . . . 1.0 105.893 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -108.56 139.73 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.302 0 O-C-N 120.721 -1.237 . . . . 1.0 108.215 -171.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -119.3 135.26 54.79 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-O 123.054 1.407 . . . . 1.0 108.673 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 62.4 tp60 -81.99 120.58 25.43 Favored 'General case' 0 N--CA 1.432 -1.336 0 C-N-CA 125.344 1.458 . . . . 1.0 110.148 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 . . . . . 0 N--CA 1.433 -1.311 0 O-C-N 121.295 -0.878 . . . . 1.0 110.847 179.156 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 966' ' ' VAL . . . . . 0.72 HG11 HG22 ' A' ' 30' ' ' VAL . 28.4 t . . . . . 0 N--CA 1.435 -1.202 0 CA-C-O 122.103 0.954 . . . . 1.0 111.943 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 967' ' ' ILE . . . . . 0.415 ' N ' HG12 ' B' ' 966' ' ' VAL . 0.4 OUTLIER -95.44 132.04 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 O-C-N 120.803 -1.185 . . . . 1.0 111.892 -157.092 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -102.0 107.95 19.24 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 125.509 1.524 . . . . 1.0 108.397 173.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.589 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.5 OUTLIER . . . . . 0 CA--C 1.494 -1.2 0 O-C-N 119.741 -1.849 . . . . 1.0 114.85 -176.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.0 p-80 . . . . . 0 N--CA 1.43 -1.449 0 N-CA-C 117.475 2.398 . . . . 1.0 117.475 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -132.68 160.73 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 C-N-CA 130.98 3.712 . . . . 1.0 105.096 173.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -112.25 144.77 41.1 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.285 -2.135 . . . . 1.0 109.757 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -137.43 160.44 39.1 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.263 -2.148 . . . . 1.0 105.854 177.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -138.05 150.68 47.14 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 119.556 -1.965 . . . . 1.0 111.416 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.429 HG22 ' CE1' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -108.77 132.82 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.612 0 C-N-CA 125.781 1.632 . . . . 1.0 108.21 174.896 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.36 130.15 56.33 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 123.976 0.91 . . . . 1.0 109.419 173.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.391 0 CA-C-O 122.566 1.092 . . . . 1.0 114.992 -176.521 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.4 p . . . . . 0 N--CA 1.436 -1.156 0 CA-C-O 121.188 0.518 . . . . 1.0 112.231 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.658 HG22 HG11 ' B' ' 966' ' ' VAL 0.26 0.7 OUTLIER -129.24 138.78 53.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 O-C-N 120.056 -1.653 . . . . 1.0 111.616 166.897 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.1 161.6 14.61 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 126.629 3.109 . . . . 1.0 115.686 173.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.429 ' CE1' HG22 ' A' ' 22' ' ' VAL . 3.6 m-85 -145.11 157.65 44.04 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.255 -2.778 . . . . 1.0 107.139 -173.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.268 24.1 ttpt -120.52 115.85 24.25 Favored 'General case' 0 N--CA 1.434 -1.238 0 C-N-CA 124.813 1.245 . . . . 1.0 109.686 -176.468 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 18.6 tt -148.56 154.74 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 CA-C-O 125.121 2.391 . . . . 1.0 112.028 -162.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.49 163.29 14.69 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 111.476 -2.602 . . . . 1.0 111.741 -177.033 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 71.0 mtt85 -71.29 -37.97 71.82 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 116.441 2.015 . . . . 1.0 116.441 -164.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -98.73 -11.51 21.85 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.581 -1.325 . . . . 1.0 112.33 -175.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.4 m -59.66 137.1 89.82 Favored Pre-proline 0 N--CA 1.435 -1.192 0 C-N-CA 126.291 1.836 . . . . 1.0 112.73 170.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -71.36 155.25 60.51 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 123.642 2.336 . . . . 1.0 114.994 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.399 2.0 pp -62.01 -25.57 67.73 Favored 'General case' 0 N--CA 1.434 -1.273 0 C-N-CA 125.539 1.535 . . . . 1.0 114.67 174.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.0 p -52.64 -29.11 24.46 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.281 -2.137 . . . . 1.0 114.86 170.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.82 -41.73 87.01 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 119.97 -1.707 . . . . 1.0 112.605 -174.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -37.28 84.96 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.78 -1.2 . . . . 1.0 113.85 170.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.0 ttm -60.2 -42.55 95.35 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 120.243 -1.536 . . . . 1.0 113.771 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.96 -43.62 98.47 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.539 -1.351 . . . . 1.0 112.497 172.268 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.73 -35.12 79.37 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 114.753 1.39 . . . . 1.0 114.753 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.55 -43.81 89.43 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 127.355 2.262 . . . . 1.0 111.767 174.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.8 m -62.25 -42.36 99.26 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 124.907 1.283 . . . . 1.0 113.531 173.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.09 -46.99 72.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 115.054 1.501 . . . . 1.0 115.054 176.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.465 ' HB2' HD11 ' B' ' 967' ' ' ILE . 2.8 mtt180 -75.6 -43.2 49.34 Favored 'General case' 0 CA--C 1.495 -1.136 0 O-C-N 120.276 -1.515 . . . . 1.0 114.722 178.081 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -114.98 8.93 15.94 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.12 0.785 . . . . 1.0 113.12 -162.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.14 9.47 86.07 Favored Glycine 0 N--CA 1.437 -1.285 0 N-CA-C 117.355 1.702 . . . . 1.0 117.355 161.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -85.82 162.77 18.5 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 121.321 -1.105 . . . . 1.0 113.446 -174.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.9 m -102.32 129.41 48.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 124.307 1.043 . . . . 1.0 110.307 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -66.54 -22.52 66.16 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 116.47 2.026 . . . . 1.0 116.47 -171.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -90.47 -1.59 57.9 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.317 -1.489 . . . . 1.0 112.759 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -100.49 -10.37 21.16 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.775 -1.203 . . . . 1.0 111.644 177.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -122.92 146.58 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 O-C-N 120.581 -1.324 . . . . 1.0 110.03 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -138.24 154.97 49.06 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.698 -1.223 . . . . 1.0 107.698 171.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -113.97 148.61 36.6 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.655 1.217 . . . . 1.0 110.74 -173.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -137.41 156.89 47.66 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.642 -1.286 . . . . 1.0 108.429 173.151 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -131.85 113.87 14.0 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 120.987 -1.071 . . . . 1.0 108.522 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 27.0 t0 53.5 46.52 26.0 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 125.534 1.534 . . . . 1.0 113.473 -177.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.65 5.78 86.42 Favored Glycine 0 N--CA 1.436 -1.32 0 O-C-N 120.209 -1.557 . . . . 1.0 116.838 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -119.12 133.14 23.73 Favored Pre-proline 0 N--CA 1.436 -1.136 0 CA-C-N 119.589 1.695 . . . . 1.0 110.137 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -73.43 142.24 32.89 Favored 'Trans proline' 0 C--N 1.308 -1.583 0 CA-C-N 124.173 2.526 . . . . 1.0 113.147 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.0 pt -120.13 145.43 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 C-N-CA 124.931 1.292 . . . . 1.0 109.968 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -109.8 162.89 14.03 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.568 -1.332 . . . . 1.0 111.001 -165.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -70.87 -13.93 62.21 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.738 -1.851 . . . . 1.0 112.796 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -83.07 -14.88 52.89 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 126.874 2.07 . . . . 1.0 112.656 169.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.87 172.24 11.56 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.744 -1.848 . . . . 1.0 111.634 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 82.7 p -147.18 157.25 46.2 Favored Pre-proline 0 CA--C 1.496 -1.097 0 O-C-N 119.962 -1.711 . . . . 1.0 110.202 -162.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -59.85 -32.53 95.49 Favored 'Trans proline' 0 N--CA 1.439 -1.685 0 C-N-CA 123.259 2.639 . . . . 1.0 115.17 170.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.59 -46.05 84.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 113.477 0.918 . . . . 1.0 113.477 175.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -68.22 -39.08 82.46 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.026 1.73 . . . . 1.0 113.355 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 17.4 tp -85.03 -8.47 58.69 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-O 121.809 0.814 . . . . 1.0 113.128 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 64.41 42.47 5.13 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 128.421 2.688 . . . . 1.0 114.996 174.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.73 154.37 39.64 Favored 'General case' 0 N--CA 1.432 -1.328 0 C-N-CA 127.836 2.454 . . . . 1.0 114.29 176.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -126.76 -175.32 3.37 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.488 -1.301 . . . . 1.0 107.488 -168.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.315 8.6 p-10 -56.51 -26.48 54.72 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 117.014 2.227 . . . . 1.0 117.014 -172.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -137.64 92.46 2.69 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 118.503 0.592 . . . . 1.0 111.682 162.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.72 164.8 11.69 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.833 -1.792 . . . . 1.0 115.119 174.656 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -126.65 120.08 28.61 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 122.52 1.153 . . . . 1.0 112.52 -173.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mt -105.7 140.73 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 C-N-CA 128.772 2.829 . . . . 1.0 109.078 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -110.92 136.08 50.47 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.305 -1.497 . . . . 1.0 107.97 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 36.5 t -115.17 138.93 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 O-C-N 120.96 -1.088 . . . . 1.0 109.546 -171.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -128.03 140.13 52.14 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-O 122.101 0.953 . . . . 1.0 110.391 172.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -90.24 126.69 35.92 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.269 1.028 . . . . 1.0 111.471 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 . . . . . 0 N--CA 1.434 -1.262 0 N-CA-C 116.178 1.918 . . . . 1.0 116.178 -167.382 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 966' ' ' VAL . . . . . 0.658 HG11 HG22 ' A' ' 30' ' ' VAL . 34.2 t . . . . . 0 N--CA 1.435 -1.206 0 CA-C-O 121.621 0.724 . . . . 1.0 109.959 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 967' ' ' ILE . . . . . 0.465 HD11 ' HB2' ' A' ' 50' ' ' ARG . 0.9 OUTLIER -90.83 130.61 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 O-C-N 120.881 -1.137 . . . . 1.0 111.37 -155.068 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -102.07 121.9 43.08 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.177 -1.577 . . . . 1.0 111.663 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.435 -1.197 0 O-C-N 120.734 -1.228 . . . . 1.0 112.704 177.027 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m80 . . . . . 0 N--CA 1.435 -1.189 0 N-CA-C 115.123 1.527 . . . . 1.0 115.123 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.404 ' HB ' ' HA ' ' A' ' 80' ' ' ASP . 19.9 pt -134.54 160.7 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 C-N-CA 129.489 3.115 . . . . 1.0 105.045 174.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -117.8 144.74 45.08 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 119.286 -2.134 . . . . 1.0 109.717 175.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.97 157.51 43.89 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 119.531 -1.98 . . . . 1.0 108.495 166.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -119.02 150.62 39.65 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-O 122.795 1.283 . . . . 1.0 113.274 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.32 133.08 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 107.567 -1.272 . . . . 1.0 107.567 173.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -142.82 140.57 31.36 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.796 1.284 . . . . 1.0 114.371 -163.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.32 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.739 174.316 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 N--CA 1.434 -1.228 0 N-CA-C 107.82 -1.178 . . . . 1.0 107.82 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.416 HG22 ' CD1' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -129.14 135.02 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 119.681 -1.887 . . . . 1.0 108.535 161.478 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.71 145.04 26.16 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 123.298 1.523 . . . . 1.0 112.785 159.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.66 ' CE2' HD21 ' B' ' 969' ' ' LEU . 0.0 OUTLIER -138.92 140.61 38.39 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.946 -1.096 . . . . 1.0 108.747 -164.634 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.681 ' O ' HD23 ' B' ' 969' ' ' LEU 0.431 31.3 ttpt -113.48 115.29 27.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.896 1.808 . . . . 1.0 111.798 -169.579 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.8 tp -142.68 154.86 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.484 0 CA-C-N 110.935 -2.848 . . . . 1.0 111.799 -153.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.254 9.2 mtpt -86.68 154.7 20.79 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 112.098 -2.319 . . . . 1.0 112.676 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -71.06 -18.05 62.58 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 117.756 2.502 . . . . 1.0 117.756 -151.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -99.65 -49.93 4.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 119.799 -1.813 . . . . 1.0 111.719 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.6 m -34.0 132.24 0.39 Allowed Pre-proline 0 N--CA 1.439 -1.023 0 C-N-CA 131.286 3.834 . . . . 1.0 118.819 -176.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -45.34 152.41 0.77 Allowed 'Trans proline' 0 N--CA 1.443 -1.456 2 N-CA-C 125.464 5.14 . . . . 1.0 125.464 -165.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -71.18 -25.77 62.68 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 157.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . 0.273 80.9 p -57.67 -29.07 64.32 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.73 -1.856 . . . . 1.0 114.089 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -62.16 -42.56 99.38 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.765 1.226 . . . . 1.0 111.075 174.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -42.9 82.82 Favored 'General case' 0 CA--C 1.491 -1.315 0 C-N-CA 127.639 2.376 . . . . 1.0 112.459 176.381 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.7 ttt -56.84 -43.07 80.75 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -65.74 -41.81 91.71 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.897 -1.127 . . . . 1.0 113.274 172.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.8 -38.71 91.76 Favored 'General case' 0 N--CA 1.435 -1.188 0 C-N-CA 124.68 1.192 . . . . 1.0 113.922 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.416 ' CD1' HG22 ' A' ' 30' ' ' VAL . 3.2 t80 -60.22 -43.2 96.2 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.802 2.041 . . . . 1.0 112.036 171.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.5 m -64.41 -43.05 95.62 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.355 -1.465 . . . . 1.0 114.182 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -65.08 -48.2 74.55 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.468 -1.395 . . . . 1.0 114.283 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -75.33 -43.22 51.86 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 115.505 1.669 . . . . 1.0 115.505 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -114.53 8.36 16.4 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 121.084 -1.01 . . . . 1.0 112.049 -163.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.88 3.43 90.53 Favored Glycine 0 CA--C 1.493 -1.288 0 N-CA-C 117.439 1.735 . . . . 1.0 117.439 159.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.55 155.27 40.23 Favored 'General case' 0 N--CA 1.434 -1.236 0 C-N-CA 125.741 1.616 . . . . 1.0 113.386 -174.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.9 m -102.19 124.93 48.64 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 120.378 -1.451 . . . . 1.0 109.144 175.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.2 ptm -60.95 -29.15 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.019 2.229 . . . . 1.0 117.019 -170.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.99 -15.54 60.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.16 -1.588 . . . . 1.0 114.218 176.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -97.32 -9.61 27.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.564 1.546 . . . . 1.0 112.287 -175.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.0 pt -120.88 143.99 31.27 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 C-N-CA 124.248 1.019 . . . . 1.0 109.597 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -135.92 154.92 50.97 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -113.93 148.54 36.66 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.484 -1.385 . . . . 1.0 109.745 -172.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -137.66 159.41 42.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 123.116 1.436 . . . . 1.0 111.927 177.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -133.25 117.42 17.36 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.177 -1.828 . . . . 1.0 107.992 170.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.7 t70 59.29 31.66 21.34 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 127.312 2.245 . . . . 1.0 113.238 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.48 2.7 88.17 Favored Glycine 0 N--CA 1.435 -1.393 0 O-C-N 119.955 -1.716 . . . . 1.0 114.646 -176.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -102.12 137.06 19.37 Favored Pre-proline 0 N--CA 1.435 -1.214 0 O-C-N 120.161 -1.788 . . . . 1.0 110.076 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -49.09 135.28 30.23 Favored 'Trans proline' 0 N--CA 1.442 -1.553 0 C-N-CA 124.547 3.498 . . . . 1.0 117.832 170.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 pt -121.89 142.49 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 108.244 -1.021 . . . . 1.0 108.244 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -97.65 167.61 10.86 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 121.143 -0.973 . . . . 1.0 110.922 -175.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -67.63 -19.92 65.28 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.444 -1.41 . . . . 1.0 112.684 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.6 m -99.43 2.0 44.69 Favored 'General case' 0 N--CA 1.436 -1.175 0 C-N-CA 126.764 2.026 . . . . 1.0 111.687 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -80.6 169.07 18.13 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 119.028 -2.295 . . . . 1.0 112.24 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.0 p -106.7 153.04 40.94 Favored Pre-proline 0 N--CA 1.438 -1.027 0 O-C-N 120.905 -1.122 . . . . 1.0 113.481 -157.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.05 -31.35 92.82 Favored 'Trans proline' 0 N--CA 1.44 -1.625 0 C-N-CA 123.374 2.716 . . . . 1.0 116.582 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.35 -45.83 78.84 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 114.029 1.122 . . . . 1.0 114.029 174.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.02 -41.3 82.36 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 125.661 1.584 . . . . 1.0 112.622 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 27.7 tp -87.19 -4.03 59.09 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 124.269 1.027 . . . . 1.0 111.601 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 56.85 44.42 23.29 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 126.554 1.942 . . . . 1.0 113.396 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 91.0 mtp -65.98 143.29 57.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.98 2.112 . . . . 1.0 115.148 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -157.56 179.58 9.1 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 105.837 -1.912 . . . . 1.0 105.837 -171.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.404 ' HA ' ' HB ' ' A' ' 18' ' ' ILE 0.3 6.7 p-10 -51.3 -26.52 7.58 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 128.511 2.724 . . . . 1.0 118.239 -178.279 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -137.78 67.45 1.42 Allowed 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 125.106 1.362 . . . . 1.0 110.638 173.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -78.38 162.68 26.26 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 119.342 -2.098 . . . . 1.0 114.409 179.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.6 m -135.39 123.64 23.12 Favored 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.36 1.064 . . . . 1.0 111.053 178.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 78.8 mt -108.0 140.54 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 C-N-CA 126.371 1.869 . . . . 1.0 108.841 174.189 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -110.97 140.12 45.74 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.612 -1.305 . . . . 1.0 108.562 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.6 t -108.53 139.07 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 O-C-N 120.559 -1.338 . . . . 1.0 109.959 -169.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -124.67 142.63 51.25 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 122.468 1.127 . . . . 1.0 110.059 173.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.7 pm0 -81.84 140.22 34.27 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.065 1.346 . . . . 1.0 111.851 -178.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.434 -1.251 0 O-C-N 120.618 -1.301 . . . . 1.0 109.971 -172.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 2.1 p . . . . . 0 CA--C 1.495 -1.172 0 CA-C-O 122.801 1.286 . . . . 1.0 111.301 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 3.6 mt -113.13 120.32 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 C-N-CA 125.092 1.357 . . . . 1.0 109.719 162.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.0 140.29 36.49 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 105.032 -2.21 . . . . 1.0 105.032 164.195 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 33' ' ' LYS . 4.0 mm? . . . . . 0 N--CA 1.438 -1.053 0 CA-C-N 122.668 2.485 . . . . 1.0 116.754 -175.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.435 -1.196 0 N-CA-C 116.005 1.854 . . . . 1.0 116.005 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.9 pt -143.04 160.75 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 C-N-CA 128.368 2.667 . . . . 1.0 107.545 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -117.66 144.85 44.83 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.143 -2.223 . . . . 1.0 108.422 174.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.692 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -127.19 150.56 49.47 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 119.835 -1.791 . . . . 1.0 107.541 173.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.9 ptpt -115.31 148.94 38.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 119.667 -1.895 . . . . 1.0 110.883 171.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.4 t -119.45 123.52 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.54 -1.652 . . . . 1.0 106.54 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.03 130.1 53.64 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.639 1.209 . . . . 1.0 112.188 -173.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.572 0 CA-C-O 122.928 1.293 . . . . 1.0 113.561 177.708 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.434 -1.244 0 N-CA-C 109.942 -0.392 . . . . 1.0 109.942 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.265 0.6 OUTLIER -129.15 138.76 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 O-C-N 119.888 -1.757 . . . . 1.0 110.571 166.477 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.401 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -118.13 149.21 41.43 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-O 124.199 1.952 . . . . 1.0 113.807 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.44 140.71 37.41 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.724 -1.86 . . . . 1.0 107.771 -162.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -103.88 115.87 31.24 Favored 'General case' 0 CA--C 1.493 -1.232 0 C-N-CA 126.304 1.842 . . . . 1.0 111.697 -175.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.692 HG21 HD22 ' A' ' 20' ' ' LEU . 11.0 tt -143.04 154.77 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.388 0 CA-C-O 124.917 2.294 . . . . 1.0 109.943 -152.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -115.03 153.6 30.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 111.716 -2.493 . . . . 1.0 110.26 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.01 -38.08 89.74 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 115.916 1.821 . . . . 1.0 115.916 -158.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -87.06 10.01 17.91 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.916 -1.115 . . . . 1.0 113.945 175.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.4 m -91.8 121.77 66.53 Favored Pre-proline 0 N--CA 1.437 -1.105 0 O-C-N 119.409 -2.057 . . . . 1.0 108.265 177.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.08 158.2 49.19 Favored 'Trans proline' 0 N--CA 1.441 -1.617 0 C-N-CA 123.13 2.554 . . . . 1.0 115.569 -175.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.448 1.5 pp -63.23 -25.66 68.43 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 115.183 1.549 . . . . 1.0 115.183 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.6 p -52.68 -29.06 24.49 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 120.37 -1.456 . . . . 1.0 114.469 170.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.24 -43.13 71.21 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 119.819 -1.801 . . . . 1.0 112.923 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.09 69.7 Favored 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 120.452 -1.405 . . . . 1.0 113.376 172.364 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.51 -43.53 98.7 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.433 -1.417 . . . . 1.0 113.289 174.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -42.57 98.6 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.686 -1.259 . . . . 1.0 113.596 170.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.23 86.76 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.21 -43.74 95.71 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 126.005 1.722 . . . . 1.0 111.695 175.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.5 m -62.5 -42.58 99.59 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.86 1.264 . . . . 1.0 114.077 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -64.57 -46.22 83.69 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 120.206 -1.558 . . . . 1.0 114.382 174.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -78.38 -43.2 28.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 116.078 1.881 . . . . 1.0 116.078 -178.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.0 mm100 -113.64 4.98 16.31 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 121.509 -0.744 . . . . 1.0 111.84 -166.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.38 84.1 Favored Glycine 0 CA--C 1.494 -1.251 0 N-CA-C 118.655 2.222 . . . . 1.0 118.655 161.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.5 mt -85.02 164.67 18.11 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 121.187 -1.184 . . . . 1.0 113.841 -172.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.9 m -102.2 135.68 43.37 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.394 -1.441 . . . . 1.0 110.709 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.2 mtp -61.82 -38.71 89.18 Favored 'General case' 0 CA--C 1.495 -1.153 0 C-N-CA 125.887 1.675 . . . . 1.0 114.308 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 ptt-85 -92.67 0.73 57.47 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 125.098 1.359 . . . . 1.0 112.751 -175.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mm-40 -92.73 -24.52 18.56 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.61 -1.306 . . . . 1.0 111.002 175.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.1 pt -120.35 149.34 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 O-C-N 120.972 -1.08 . . . . 1.0 110.82 -174.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -134.41 154.97 51.09 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 107.872 -1.159 . . . . 1.0 107.872 168.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -106.51 148.6 28.02 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 -175.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -142.26 155.36 45.23 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 114.834 1.42 . . . . 1.0 114.834 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -115.19 107.45 15.31 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 106.948 -1.501 . . . . 1.0 106.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.2 t70 52.71 33.32 13.66 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 114.84 1.422 . . . . 1.0 114.84 175.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.49 5.78 89.16 Favored Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 118.755 2.262 . . . . 1.0 118.755 -177.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -123.63 152.83 66.0 Favored Pre-proline 0 N--CA 1.436 -1.145 0 CA-C-O 111.748 -3.977 . . . . 1.0 103.887 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.786 57.9 Cg_exo 71.97 155.76 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.827 2 C-N-CA 111.555 -5.163 . . . . 1.0 116.871 169.535 . . . . . . . . 3 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.295 5.9 pt -123.91 159.24 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 1 C-N-CA 135.01 5.324 . . . . 1.0 111.136 17.769 . . . . . . . . 3 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -102.82 163.02 12.46 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 120.816 1.644 . . . . 1.0 110.62 172.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.98 -34.63 75.08 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 119.102 -2.248 . . . . 1.0 115.257 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.4 m -92.03 8.53 37.28 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.5 1.12 . . . . 1.0 111.882 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -81.8 172.74 13.0 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.302 -2.124 . . . . 1.0 108.88 163.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 47.7 p -147.03 159.69 42.17 Favored Pre-proline 0 CA--C 1.498 -1.056 0 O-C-N 119.186 -2.196 . . . . 1.0 111.985 -163.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -59.4 -32.17 96.07 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.602 2.868 . . . . 1.0 115.674 168.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.38 -46.08 81.52 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 119.293 0.951 . . . . 1.0 113.154 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -69.22 -41.39 77.1 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 125.507 1.523 . . . . 1.0 113.605 -177.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -79.94 -8.41 59.31 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.661 -1.275 . . . . 1.0 112.805 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.12 46.87 7.72 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 126.124 1.77 . . . . 1.0 113.753 -178.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.0 mtt -62.26 153.78 29.64 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 126.767 2.027 . . . . 1.0 114.047 173.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.59 -179.9 3.93 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.172 0.989 . . . . 1.0 109.277 -171.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -57.3 -26.6 61.13 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 127.155 2.182 . . . . 1.0 116.007 -175.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -136.54 91.37 2.65 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 107.785 -1.191 . . . . 1.0 107.785 161.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.42 161.43 19.43 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.97 -1.706 . . . . 1.0 112.418 173.424 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.3 m -130.17 115.3 16.82 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 122.224 1.012 . . . . 1.0 110.742 -177.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 140.68 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 126.841 2.056 . . . . 1.0 108.363 -172.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -110.97 151.35 28.04 Favored 'General case' 0 N--CA 1.433 -1.279 0 O-C-N 120.008 -1.682 . . . . 1.0 110.272 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.0 t -108.66 139.56 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 O-C-N 121.026 -1.046 . . . . 1.0 110.29 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -132.43 139.78 48.16 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-O 122.102 0.953 . . . . 1.0 110.036 165.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -87.85 141.21 28.77 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 124.476 1.11 . . . . 1.0 111.482 -175.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 . . . . . 0 N--CA 1.434 -1.242 0 C-N-CA 124.641 1.176 . . . . 1.0 113.101 -177.296 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER . . . . . 0 N--CA 1.436 -1.148 0 N-CA-C 114.728 1.381 . . . . 1.0 114.728 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -107.82 120.13 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.21 0 N-CA-C 107.094 -1.447 . . . . 1.0 107.094 -172.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -102.17 116.9 33.63 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.204 -1.56 . . . . 1.0 107.14 164.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.496 -1.108 0 CA-C-N 120.346 1.43 . . . . 1.0 114.851 -175.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.6 p80 . . . . . 0 N--CA 1.434 -1.227 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.7 pt -135.25 160.65 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 131.213 3.805 . . . . 1.0 106.847 -175.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -113.86 144.9 42.26 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 118.818 -2.426 . . . . 1.0 110.832 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.33 157.62 46.36 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.476 -2.64 . . . . 1.0 105.687 175.104 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -119.99 150.66 40.17 Favored 'General case' 0 N--CA 1.434 -1.226 0 C-N-CA 127.32 2.248 . . . . 1.0 112.654 171.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.83 132.37 54.32 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.188 0 N-CA-C 106.242 -1.762 . . . . 1.0 106.242 169.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.66 130.15 56.18 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 121.467 0.651 . . . . 1.0 109.479 169.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.372 0 C-N-CA 124.774 1.178 . . . . 1.0 114.69 -176.966 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.436 -1.156 0 CA-C-O 121.933 0.873 . . . . 1.0 111.398 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.824 HG22 HG11 ' B' ' 966' ' ' VAL . 0.6 OUTLIER -129.14 138.71 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.243 -1.536 . . . . 1.0 107.852 168.279 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.528 ' H ' HG21 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -114.8 158.06 22.4 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 126.538 3.066 . . . . 1.0 113.49 172.504 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.474 ' CE1' ' CG1' ' A' ' 30' ' ' VAL 0.271 25.6 m-85 -145.11 148.23 33.41 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 118.218 -2.801 . . . . 1.0 109.214 -159.575 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -116.51 115.7 26.26 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 120.496 1.498 . . . . 1.0 112.965 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 20.9 tt -150.9 154.75 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 125.665 2.65 . . . . 1.0 111.538 -164.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.69 163.01 13.71 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 110.983 -2.826 . . . . 1.0 111.731 -172.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -69.94 -37.11 75.78 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 117.582 2.438 . . . . 1.0 117.582 -162.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -88.44 -24.32 23.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.401 -1.437 . . . . 1.0 113.174 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m -60.68 137.08 92.94 Favored Pre-proline 0 N--CA 1.438 -1.073 0 C-N-CA 126.544 1.938 . . . . 1.0 114.037 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -76.54 157.2 36.38 Favored 'Trans proline' 0 N--CA 1.441 -1.568 0 CA-C-N 123.76 2.378 . . . . 1.0 115.235 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.319 1.4 pp -62.84 -25.71 68.4 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 125.341 1.456 . . . . 1.0 114.643 179.055 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.0 t -52.8 -29.08 25.57 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.663 -1.898 . . . . 1.0 115.216 170.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HG3' HD12 ' B' ' 969' ' ' LEU . 0.1 OUTLIER -70.12 -45.58 66.57 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.01 -1.681 . . . . 1.0 111.039 -170.34 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.484 HD13 ' H ' ' A' ' 43' ' ' LEU 0.332 0.0 OUTLIER -65.81 -36.5 83.67 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 115.151 1.537 . . . . 1.0 115.151 171.465 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.1 tpp -62.27 -40.66 96.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 114.738 1.385 . . . . 1.0 114.738 177.671 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -65.7 -41.11 92.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 O-C-N 120.054 -1.654 . . . . 1.0 112.793 171.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.89 -37.14 83.48 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.697 -1.252 . . . . 1.0 114.078 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.39 -44.94 89.16 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.189 -1.569 . . . . 1.0 112.427 171.033 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.6 m -61.75 -39.96 93.45 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 124.126 0.97 . . . . 1.0 113.184 175.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -66.29 -47.82 72.37 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.5 1.12 . . . . 1.0 113.86 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -69.03 -43.32 74.96 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.383 -1.448 . . . . 1.0 114.621 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.2 mm100 -114.19 8.47 16.87 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 114.302 1.223 . . . . 1.0 114.302 -163.214 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.03 42.23 12.68 Favored Glycine 0 CA--C 1.494 -1.264 0 N-CA-C 116.355 1.302 . . . . 1.0 116.355 163.167 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 30.5 mt -116.63 162.87 16.97 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 121.176 -1.191 . . . . 1.0 110.165 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 55.0 m -102.36 132.55 48.27 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.535 -1.353 . . . . 1.0 110.019 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.8 tpt -61.78 -40.67 96.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 126.145 1.778 . . . . 1.0 114.229 -166.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -97.62 13.21 30.93 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.708 -1.245 . . . . 1.0 112.131 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -105.93 -7.51 18.14 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 124.22 1.008 . . . . 1.0 111.34 171.024 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.4 pt -111.76 136.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 O-C-N 121.095 -1.003 . . . . 1.0 110.015 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.1 mmt180 -123.79 139.03 54.38 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.709 -1.244 . . . . 1.0 109.54 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.432 ' HB2' HD11 ' A' ' 67' ' ' ILE . 0.1 OUTLIER -120.27 143.94 48.05 Favored 'General case' 0 N--CA 1.433 -1.323 0 O-C-N 120.675 -1.266 . . . . 1.0 111.48 -162.402 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -141.11 154.79 46.08 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 124.508 1.123 . . . . 1.0 110.445 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -133.62 117.92 17.61 Favored 'General case' 0 N--CA 1.433 -1.305 0 O-C-N 120.626 -1.296 . . . . 1.0 108.351 176.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 44.2 t0 51.62 45.05 28.7 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.117 1.767 . . . . 1.0 112.713 -175.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.2 0.96 72.78 Favored Glycine 0 N--CA 1.436 -1.349 0 N-CA-C 116.58 1.392 . . . . 1.0 116.58 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -112.64 128.92 24.94 Favored Pre-proline 0 N--CA 1.436 -1.125 0 O-C-N 120.027 -1.867 . . . . 1.0 110.728 -174.41 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -48.53 136.19 26.56 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 124.686 3.591 . . . . 1.0 117.952 170.034 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.432 HD11 ' HB2' ' A' ' 60' ' ' PHE . 4.3 pt -123.19 154.18 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.183 0 C-N-CA 125.36 1.464 . . . . 1.0 109.349 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -110.49 161.2 15.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 121.036 -1.04 . . . . 1.0 109.049 -171.036 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -65.88 -25.6 67.25 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 119.536 -1.978 . . . . 1.0 113.243 173.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 m -78.42 -18.4 55.03 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.531 1.932 . . . . 1.0 112.947 173.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -67.52 160.26 28.01 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-O 124.189 1.947 . . . . 1.0 112.495 174.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.3 p -144.31 162.22 40.85 Favored Pre-proline 0 CA--C 1.496 -1.133 0 CA-C-N 114.472 -1.24 . . . . 1.0 110.025 -158.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -60.56 -32.44 93.5 Favored 'Trans proline' 0 N--CA 1.439 -1.698 0 C-N-CA 123.2 2.6 . . . . 1.0 114.558 168.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.22 -45.73 83.52 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 122.264 1.03 . . . . 1.0 113.155 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -71.22 -44.36 65.53 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 124.735 1.214 . . . . 1.0 113.2 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -87.75 -8.35 56.14 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 113.568 0.951 . . . . 1.0 113.568 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.29 42.24 15.29 Favored 'General case' 0 N--CA 1.435 -1.214 0 C-N-CA 128.664 2.786 . . . . 1.0 115.901 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtm -69.61 154.24 42.29 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 126.861 2.065 . . . . 1.0 113.832 169.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -141.02 -175.09 4.18 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 105.919 -1.882 . . . . 1.0 105.919 -164.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.337 4.0 p-10 -50.45 -26.47 5.11 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 118.875 2.917 . . . . 1.0 118.875 -167.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -141.48 58.54 1.51 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.34 1.056 . . . . 1.0 113.062 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 169.35 16.87 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 119.005 -2.31 . . . . 1.0 116.821 -173.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.3 m -131.87 122.12 25.17 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 124.998 1.319 . . . . 1.0 112.182 -176.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 52.8 mt -112.91 140.73 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.061 0 C-N-CA 127.65 2.38 . . . . 1.0 108.132 175.207 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -110.95 134.28 52.7 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 120.66 -1.275 . . . . 1.0 108.615 -177.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.69 132.96 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 C-N-CA 125.328 1.451 . . . . 1.0 107.139 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -130.52 134.23 46.88 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.732 1.253 . . . . 1.0 110.956 177.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -88.05 140.25 29.68 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 124.988 1.315 . . . . 1.0 112.968 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 N--CA 1.434 -1.238 0 C-N-CA 126.017 1.727 . . . . 1.0 112.162 -172.78 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 966' ' ' VAL . . . . . 0.824 HG11 HG22 ' A' ' 30' ' ' VAL . 2.2 t . . . . . 0 N--CA 1.437 -1.1 0 N-CA-C 113.391 0.886 . . . . 1.0 113.391 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -109.56 125.19 66.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 O-C-N 118.962 -2.337 . . . . 1.0 112.763 -146.664 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -99.37 125.05 44.98 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.12 2.168 . . . . 1.0 110.382 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.508 HD12 ' HG3' ' A' ' 42' ' ' LYS . 2.0 mm? . . . . . 0 N--CA 1.436 -1.136 0 N-CA-C 116.165 1.913 . . . . 1.0 116.165 -173.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.497 -1.058 0 N-CA-C 115.85 1.796 . . . . 1.0 115.85 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.6 pt -140.35 160.76 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 128.568 2.747 . . . . 1.0 105.832 175.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -109.44 144.75 37.24 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 118.838 -2.414 . . . . 1.0 107.995 168.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -137.38 147.76 45.72 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.613 -1.93 . . . . 1.0 106.988 175.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -116.83 150.59 38.12 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 125.6 1.56 . . . . 1.0 113.022 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.453 HG23 HD11 ' A' ' 43' ' ' LEU . 9.9 t -111.78 125.98 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.206 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 170.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.34 134.48 54.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 122.406 1.098 . . . . 1.0 112.593 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.398 0 O-C-N 120.744 -1.222 . . . . 1.0 111.319 177.022 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.4 t . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 109.195 -0.668 . . . . 1.0 109.195 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.18 138.73 53.69 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 O-C-N 120.236 -1.54 . . . . 1.0 110.383 169.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.12 145.05 50.12 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 123.183 1.468 . . . . 1.0 112.696 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.621 ' CD2' HG21 ' B' ' 967' ' ' ILE 0.342 0.5 OUTLIER -144.41 140.61 29.11 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.118 -1.614 . . . . 1.0 108.627 -158.274 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.323 35.6 ttpt -110.96 115.5 29.59 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 123.428 1.585 . . . . 1.0 112.037 -170.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.72 HD11 HG21 ' A' ' 38' ' ' THR . 4.6 tp -154.81 154.83 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 127.498 3.523 . . . . 1.0 112.624 -163.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.706 ' H ' HD12 ' A' ' 34' ' ' ILE . 11.4 mptt -64.12 142.88 58.25 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 109.414 -3.539 . . . . 1.0 113.685 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.9 ttt-85 -71.2 -28.48 64.25 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.168 -1.378 . . . . 1.0 113.516 -173.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -76.21 -29.84 57.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 115.648 1.721 . . . . 1.0 115.648 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.72 HG21 HD11 ' A' ' 34' ' ' ILE . 75.0 m -62.49 141.26 96.68 Favored Pre-proline 0 N--CA 1.439 -1.004 0 C-N-CA 127.425 2.29 . . . . 1.0 114.288 -175.453 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -56.27 145.93 74.89 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 123.957 3.104 . . . . 1.0 116.797 174.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.426 HD21 ' O ' ' A' ' 68' ' ' ASN 0.291 1.3 pt? -63.74 -25.61 68.27 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 114.498 1.296 . . . . 1.0 114.498 172.108 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.8 t -52.64 -29.13 24.58 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 125.787 1.635 . . . . 1.0 114.62 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -65.77 -42.47 90.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.314 -2.116 . . . . 1.0 112.553 176.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.453 HD11 HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -62.87 -41.58 99.44 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 126.441 1.896 . . . . 1.0 114.463 171.411 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 77.0 mtp -57.31 -45.9 83.75 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 113.578 0.955 . . . . 1.0 113.578 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -66.35 -40.2 89.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.456 -1.403 . . . . 1.0 113.044 173.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.34 83.41 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.563 -1.336 . . . . 1.0 114.054 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -61.58 -42.28 98.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 O-C-N 120.21 -1.556 . . . . 1.0 110.83 172.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.8 m -61.35 -46.34 90.65 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.135 1.532 . . . . 1.0 115.135 173.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -69.55 -49.85 50.47 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 115.873 1.805 . . . . 1.0 115.873 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -70.63 -38.18 73.88 Favored 'General case' 0 CA--C 1.493 -1.236 0 C-N-CA 125.632 1.573 . . . . 1.0 113.877 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.96 10.95 20.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 O-C-N 121.509 -0.745 . . . . 1.0 111.676 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.81 44.75 24.06 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.756 1.462 . . . . 1.0 116.756 161.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.2 mt -121.66 154.47 36.79 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 121.469 -1.019 . . . . 1.0 110.957 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.0 m -100.14 136.27 40.29 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 120.514 -1.366 . . . . 1.0 109.923 174.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.4 tpt -59.55 -35.05 73.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.86 2.064 . . . . 1.0 114.055 -176.077 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ptt-85 -90.0 4.15 51.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.203 1.801 . . . . 1.0 111.151 -174.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.02 -14.49 16.44 Favored 'General case' 0 N--CA 1.432 -1.367 0 O-C-N 121.024 -1.047 . . . . 1.0 111.854 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.6 pt -127.76 159.97 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 119.897 1.226 . . . . 1.0 112.282 -166.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -138.31 147.71 43.85 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.201 -1.037 . . . . 1.0 108.201 169.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.458 ' HB3' HD11 ' A' ' 67' ' ' ILE . 63.5 m-85 -104.6 144.57 31.52 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 126.455 1.902 . . . . 1.0 107.438 -172.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.687 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 7.5 tmm_? -152.19 144.81 24.21 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 -167.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.687 ' CG ' ' HA ' ' A' ' 61' ' ' ARG 0.804 0.0 OUTLIER -123.1 142.63 50.67 Favored 'General case' 0 N--CA 1.408 -2.566 1 N-CA-C 94.606 -6.072 . . . . 1.0 94.606 -122.145 . . . . . . . . 5 4 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -69.83 74.68 0.44 Allowed 'General case' 0 N--CA 1.438 -1.038 0 O-C-N 119.747 -1.845 . . . . 1.0 115.434 -159.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.42 3.93 78.73 Favored Glycine 0 N--CA 1.433 -1.518 0 C-N-CA 127.639 2.542 . . . . 1.0 112.251 -159.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.632 ' O ' ' HB2' ' A' ' 62' ' ' PHE . 53.4 mt-30 -123.75 153.22 66.77 Favored Pre-proline 0 N--CA 1.428 -1.532 1 N-CA-C 99.719 -4.178 . . . . 1.0 99.719 -158.3 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.65 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 55.5 Cg_endo -72.12 135.97 26.1 Favored 'Trans proline' 0 N--CA 1.444 -1.406 1 C-N-CA 125.457 4.105 . . . . 1.0 116.295 148.22 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.567 HG12 ' HB3' ' A' ' 62' ' ' PHE . 5.8 pt -117.59 127.24 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.117 0 C-N-CA 126.897 2.079 . . . . 1.0 108.976 171.378 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.426 ' O ' HD21 ' A' ' 40' ' ' LEU . 39.4 m-80 -112.8 158.75 19.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 125.381 1.473 . . . . 1.0 108.772 175.443 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -59.99 -25.32 65.15 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 118.9 -2.375 . . . . 1.0 116.947 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 m -92.35 -2.27 56.49 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.622 -1.299 . . . . 1.0 111.351 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -73.18 171.81 12.28 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 119.311 -2.118 . . . . 1.0 111.988 172.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 64.9 p -146.34 154.41 49.37 Favored Pre-proline 0 CA--C 1.495 -1.141 0 O-C-N 120.097 -1.627 . . . . 1.0 109.415 -162.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.404 ' HB3' ' HB2' ' A' ' 78' ' ' MET . 39.7 Cg_exo -58.16 -31.64 93.8 Favored 'Trans proline' 0 N--CA 1.44 -1.672 0 C-N-CA 123.272 2.648 . . . . 1.0 116.078 170.127 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.09 89.99 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -74.35 -41.11 61.59 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.966 1.306 . . . . 1.0 113.306 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.78 -8.49 59.7 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 122.124 0.964 . . . . 1.0 112.665 178.017 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.289 42.2 mm-40 64.43 48.16 2.82 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 126.204 1.802 . . . . 1.0 114.416 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.404 ' HB2' ' HB3' ' A' ' 73' ' ' PRO . 66.2 mtt -82.05 154.25 25.72 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 127.03 2.132 . . . . 1.0 111.06 172.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -125.89 -178.98 4.47 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 121.062 -1.024 . . . . 1.0 109.396 -164.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.376 9.1 p-10 -54.1 -26.55 27.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 117.217 2.303 . . . . 1.0 117.217 -174.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -135.75 89.49 2.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 123.277 0.631 . . . . 1.0 111.366 158.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.7 170.53 10.06 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 116.765 2.135 . . . . 1.0 116.765 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.9 m -135.87 120.95 18.84 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 125.008 1.323 . . . . 1.0 112.473 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.8 mt -110.22 140.78 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.106 0 C-N-CA 129.972 3.309 . . . . 1.0 108.31 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -110.82 146.43 36.43 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.939 -1.726 . . . . 1.0 108.693 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.4 t -121.18 139.69 47.59 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.218 0 O-C-N 121.17 -0.956 . . . . 1.0 108.969 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -128.58 143.24 50.92 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 121.367 -0.833 . . . . 1.0 111.14 163.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -87.16 130.27 34.6 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.739 1.257 . . . . 1.0 112.76 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 . . . . . 0 N--CA 1.434 -1.248 0 C-N-CA 125.169 1.387 . . . . 1.0 111.147 -179.184 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 16.5 t . . . . . 0 CA--C 1.496 -1.134 0 CA-C-O 123.978 1.847 . . . . 1.0 114.012 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 967' ' ' ILE . . . . . 0.621 HG21 ' CD2' ' A' ' 32' ' ' PHE . 6.5 mt -113.05 111.01 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 C-N-CA 127.127 2.171 . . . . 1.0 110.808 -171.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -102.18 109.08 20.67 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 119.172 -2.205 . . . . 1.0 112.703 171.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.501 ' CD1' HD13 ' A' ' 34' ' ' ILE 0.275 0.4 OUTLIER . . . . . 0 CA--C 1.496 -1.115 0 CA-C-N 122.713 2.506 . . . . 1.0 114.433 -172.101 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.437 -1.1 0 N-CA-C 115.511 1.671 . . . . 1.0 115.511 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -140.66 160.68 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 127.306 2.242 . . . . 1.0 109.158 -172.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -117.72 144.77 44.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 118.87 -2.393 . . . . 1.0 109.127 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -127.91 157.49 40.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 O-C-N 119.136 -2.227 . . . . 1.0 106.159 167.066 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 14.4 ptpt -109.35 150.6 27.78 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 125.578 1.551 . . . . 1.0 110.539 161.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.417 HG22 ' HB ' ' A' ' 84' ' ' ILE . 39.4 t -116.94 124.93 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 171.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.06 130.13 51.66 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 122.654 1.216 . . . . 1.0 111.837 -176.393 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.404 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . . . . . . 0 N--CA 1.434 -1.472 0 CA-C-O 122.763 1.202 . . . . 1.0 115.727 -176.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.435 -1.223 0 CA-C-O 122.297 1.046 . . . . 1.0 113.26 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.24 138.81 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.07 0 O-C-N 119.776 -1.827 . . . . 1.0 109.637 160.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -119.96 139.5 52.37 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-O 123.163 1.459 . . . . 1.0 112.309 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.521 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.0 OUTLIER -145.05 142.57 29.84 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.412 -1.43 . . . . 1.0 113.949 -163.061 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.427 ' O ' HD23 ' B' ' 969' ' ' LEU 0.305 14.0 ttpt -109.34 115.71 30.48 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.696 1.236 . . . . 1.0 114.2 -167.246 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 14.0 tt -146.28 154.75 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.461 0 CA-C-O 126.183 2.897 . . . . 1.0 110.012 -152.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.5 mtpp -107.65 158.07 17.56 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 110.768 -2.923 . . . . 1.0 111.413 -171.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -68.96 -37.99 79.14 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 117.275 2.324 . . . . 1.0 117.275 -151.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -87.95 -12.08 45.66 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 120.683 -1.26 . . . . 1.0 113.658 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 94.6 m -60.1 144.28 87.17 Favored Pre-proline 0 N--CA 1.437 -1.077 0 C-N-CA 128.091 2.556 . . . . 1.0 114.315 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -65.66 148.9 87.51 Favored 'Trans proline' 0 N--CA 1.44 -1.647 0 CA-C-N 124.935 2.798 . . . . 1.0 116.04 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.572 ' HA ' HD22 ' A' ' 43' ' ' LEU 0.368 0.6 OUTLIER -64.06 -25.66 68.21 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 115.266 1.58 . . . . 1.0 115.266 169.354 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.1 t -52.49 -29.04 22.94 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 126.917 2.087 . . . . 1.0 112.603 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -67.5 -36.87 81.9 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.431 -1.418 . . . . 1.0 111.822 -178.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.572 HD22 ' HA ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -64.08 -42.25 97.02 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 125.036 1.335 . . . . 1.0 112.144 172.015 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 ttm -58.39 -43.14 88.41 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 113.96 1.096 . . . . 1.0 113.96 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.19 -41.97 94.02 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.258 1.023 . . . . 1.0 112.429 173.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -38.6 90.43 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.525 -1.359 . . . . 1.0 114.459 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.472 ' CE2' HD12 ' A' ' 53' ' ' LEU . 12.5 t80 -60.98 -41.28 96.15 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 126.37 1.868 . . . . 1.0 111.769 173.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.2 m -62.92 -45.11 94.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.802 -1.186 . . . . 1.0 113.987 171.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -64.52 -51.74 61.34 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 119.944 -1.723 . . . . 1.0 114.618 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -76.43 -43.27 40.91 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 115.028 1.492 . . . . 1.0 115.028 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.63 2.25 25.8 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 121.289 -0.882 . . . . 1.0 110.602 -166.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.54 7.94 85.54 Favored Glycine 0 CA--C 1.493 -1.316 0 N-CA-C 117.576 1.79 . . . . 1.0 117.576 164.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.472 HD12 ' CE2' ' A' ' 47' ' ' TYR . 10.1 mt -83.79 166.76 17.72 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 119.165 1.482 . . . . 1.0 113.577 -172.454 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 67.1 m -102.28 131.47 48.84 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.519 -1.363 . . . . 1.0 112.052 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.5 ptp -66.51 -30.38 70.69 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt85 -75.18 -18.51 60.15 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.187 -1.571 . . . . 1.0 113.54 175.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -93.85 -10.62 33.38 Favored 'General case' 0 N--CA 1.435 -1.216 0 O-C-N 120.874 -1.141 . . . . 1.0 112.812 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.6 pt -114.15 146.5 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 C-N-CA 124.233 1.013 . . . . 1.0 111.204 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -136.93 137.08 39.18 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.731 -1.231 . . . . 1.0 108.479 167.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -103.27 148.62 25.61 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.024 -1.048 . . . . 1.0 111.227 -174.174 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -138.7 162.09 35.54 Favored 'General case' 0 N--CA 1.433 -1.276 0 O-C-N 120.97 -1.081 . . . . 1.0 109.864 174.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -115.33 110.04 18.8 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.561 -0.903 . . . . 1.0 108.561 164.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.5 t0 41.29 55.65 3.28 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.303 2.241 . . . . 1.0 114.738 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 2.32 90.64 Favored Glycine 0 N--CA 1.435 -1.368 0 N-CA-C 117.691 1.836 . . . . 1.0 117.691 -176.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -109.87 119.64 47.01 Favored Pre-proline 0 N--CA 1.435 -1.175 0 CA-C-N 120.954 2.377 . . . . 1.0 110.786 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -46.61 136.98 15.8 Favored 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 124.525 3.483 . . . . 1.0 117.391 165.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 pt -123.26 153.56 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 C-N-CA 125.132 1.373 . . . . 1.0 107.878 177.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -112.6 162.15 16.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.612 -1.305 . . . . 1.0 110.747 -172.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -73.93 -15.25 61.13 Favored 'General case' 0 N--CA 1.436 -1.135 0 O-C-N 119.16 -2.212 . . . . 1.0 115.058 -176.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.8 m -95.16 -3.64 47.52 Favored 'General case' 0 N--CA 1.438 -1.066 0 O-C-N 120.606 -1.309 . . . . 1.0 111.65 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -73.1 169.98 15.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 118.22 -2.8 . . . . 1.0 111.369 169.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 53.2 p -148.32 160.52 36.65 Favored Pre-proline 0 CA--C 1.495 -1.146 0 O-C-N 119.707 -1.871 . . . . 1.0 110.125 -157.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -58.51 -34.52 98.85 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.301 2.667 . . . . 1.0 114.748 167.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.1 -45.99 75.55 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 114.118 1.155 . . . . 1.0 114.118 175.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -70.41 -39.06 74.68 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.115 1.366 . . . . 1.0 114.056 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.6 tp -86.9 -8.49 57.22 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 120.759 -1.213 . . . . 1.0 112.355 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.263 40.7 mt-10 61.97 43.86 8.74 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 126.64 1.976 . . . . 1.0 114.382 177.742 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.2 mtt -57.23 154.19 10.72 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 128.262 2.625 . . . . 1.0 113.052 167.127 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -116.99 -177.44 3.2 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 120.981 -1.074 . . . . 1.0 108.848 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.373 10.4 p-10 -57.74 -26.6 62.06 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 126.318 1.847 . . . . 1.0 115.636 -178.322 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -139.15 85.94 2.1 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.13 1.772 . . . . 1.0 110.344 166.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.28 165.37 16.5 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 120.432 -1.417 . . . . 1.0 113.807 175.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 69.5 m -132.01 121.37 23.79 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.216 1.406 . . . . 1.0 110.677 172.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.417 ' HB ' HG22 ' A' ' 22' ' ' VAL . 46.2 mm -115.55 140.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 C-N-CA 127.134 2.174 . . . . 1.0 109.315 -178.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -111.16 139.83 46.22 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 120.193 -1.567 . . . . 1.0 111.97 -164.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.404 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 9.9 t -113.15 133.61 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 CA-C-O 122.766 1.27 . . . . 1.0 111.165 -178.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.74 138.11 51.71 Favored 'General case' 0 N--CA 1.433 -1.279 0 CA-C-O 122.554 1.169 . . . . 1.0 110.651 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.7 mm100 -89.43 137.01 32.7 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 124.242 1.017 . . . . 1.0 111.195 -175.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 . . . . . 0 N--CA 1.433 -1.291 0 N-CA-C 115.219 1.562 . . . . 1.0 115.219 -174.969 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.435 -1.219 0 CA-C-O 123.494 1.616 . . . . 1.0 113.974 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 967' ' ' ILE . . . . . 0.521 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 7.0 mt -113.21 129.09 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 C-N-CA 127.454 2.302 . . . . 1.0 113.298 -165.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -102.08 129.59 48.46 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.292 -1.505 . . . . 1.0 108.174 167.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.427 HD23 ' O ' ' A' ' 33' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.437 -1.095 0 N-CA-C 117.919 2.563 . . . . 1.0 117.919 -170.308 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.5 m170 . . . . . 0 N--CA 1.437 -1.121 0 N-CA-C 112.618 0.599 . . . . 1.0 112.618 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 24.7 pt -143.03 160.65 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 126.394 1.877 . . . . 1.0 106.951 170.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -117.71 144.8 44.92 Favored 'General case' 0 N--CA 1.432 -1.33 0 O-C-N 119.3 -2.125 . . . . 1.0 108.982 176.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -127.5 146.04 50.64 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 119.938 -1.726 . . . . 1.0 107.455 168.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.9 ptpt -106.45 150.62 25.89 Favored 'General case' 0 CA--C 1.493 -1.22 0 O-C-N 120.111 -1.618 . . . . 1.0 111.311 165.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.4 p -119.22 124.52 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 N-CA-C 107.106 -1.442 . . . . 1.0 107.106 172.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 130.2 49.07 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 123.083 1.42 . . . . 1.0 112.739 -171.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.442 0 CA-C-O 123.256 1.476 . . . . 1.0 115.801 -178.022 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.4 t . . . . . 0 N--CA 1.436 -1.157 0 CA-C-O 120.72 0.295 . . . . 1.0 110.922 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -128.04 137.88 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 N-CA-C 106.08 -1.822 . . . . 1.0 106.08 163.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.43 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -117.73 140.15 50.07 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-O 123.61 1.671 . . . . 1.0 111.269 161.66 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.56 ' CD2' HG21 ' B' ' 967' ' ' ILE 0.355 10.8 t80 -139.91 140.48 36.44 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 -155.141 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.279 27.3 ttpt -115.02 115.64 27.16 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-O 122.403 1.097 . . . . 1.0 111.013 -171.191 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.402 HD12 ' HE1' ' A' ' 32' ' ' PHE . 3.1 tt -140.09 154.7 23.46 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-O 124.216 1.96 . . . . 1.0 111.997 -155.25 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -100.24 157.3 16.69 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 123.282 1.515 . . . . 1.0 111.758 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 ttt-85 -71.25 -23.12 61.93 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 117.848 2.536 . . . . 1.0 117.848 -154.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -90.44 -19.68 23.62 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.039 -1.663 . . . . 1.0 112.438 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.5 m -60.9 140.45 93.62 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 126.33 1.852 . . . . 1.0 114.132 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -68.62 152.05 74.76 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 CA-C-N 124.052 2.483 . . . . 1.0 116.308 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.291 0.4 OUTLIER -69.06 -25.47 64.47 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 126.657 1.983 . . . . 1.0 112.41 168.784 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 89.9 p -52.69 -29.15 25.02 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.098 -2.251 . . . . 1.0 115.024 173.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -67.74 -36.07 79.88 Favored 'General case' 0 N--CA 1.427 -1.614 0 O-C-N 119.75 -1.844 . . . . 1.0 110.686 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.431 ' HA ' ' CE2' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -63.57 -41.94 98.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 127.553 2.341 . . . . 1.0 112.497 171.011 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 56.1 ttm -61.53 -44.49 96.96 Favored 'General case' 0 N--CA 1.433 -1.28 0 O-C-N 120.857 -1.152 . . . . 1.0 113.7 174.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -67.21 -40.08 86.4 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.226 -0.921 . . . . 1.0 112.747 176.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.412 ' HB1' HD13 ' B' ' 967' ' ' ILE . . . -64.99 -38.6 91.49 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.763 -1.21 . . . . 1.0 113.686 179.176 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -59.77 -40.11 87.1 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.218 1.807 . . . . 1.0 111.907 170.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.9 m -67.72 -44.4 77.74 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.629 -1.92 . . . . 1.0 114.489 172.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.42 -46.51 76.26 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.054 -1.654 . . . . 1.0 114.045 179.376 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 24.6 mtt180 -78.59 -42.19 29.71 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 116.572 2.064 . . . . 1.0 116.572 177.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.15 4.83 25.29 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.8 -1.187 . . . . 1.0 112.001 -166.073 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.11 5.72 85.46 Favored Glycine 0 N--CA 1.438 -1.22 0 N-CA-C 117.856 1.902 . . . . 1.0 117.856 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.15 165.5 20.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.916 -1.344 . . . . 1.0 113.748 -173.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -102.34 129.71 48.87 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.326 -1.484 . . . . 1.0 111.036 171.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -66.47 -22.52 66.2 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 119.835 -1.791 . . . . 1.0 115.464 -172.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -91.29 3.87 53.77 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 124.937 1.295 . . . . 1.0 112.513 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -112.91 -6.12 13.8 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 124.622 1.169 . . . . 1.0 112.4 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 31.6 pt -124.35 142.46 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.694 -1.253 . . . . 1.0 110.263 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -138.21 154.93 49.09 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 124.86 1.264 . . . . 1.0 108.159 172.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -116.04 148.71 39.9 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-O 123.028 1.394 . . . . 1.0 112.923 -167.336 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -136.3 152.55 50.81 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-O 122.421 1.105 . . . . 1.0 110.072 175.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -130.55 111.58 12.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.728 1.211 . . . . 1.0 108.733 -178.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.8 t70 48.63 44.85 21.42 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 126.409 1.883 . . . . 1.0 113.997 -174.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.5 1.69 88.96 Favored Glycine 0 N--CA 1.436 -1.323 0 N-CA-C 117.051 1.58 . . . . 1.0 117.051 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -109.96 137.7 20.56 Favored Pre-proline 0 N--CA 1.436 -1.175 0 CA-C-N 119.978 1.889 . . . . 1.0 110.365 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.74 144.99 36.05 Favored 'Trans proline' 0 N--CA 1.44 -1.659 0 C-N-CA 122.616 2.211 . . . . 1.0 112.466 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.0 pt -120.75 151.28 23.64 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.141 0 C-N-CA 124.644 1.177 . . . . 1.0 108.828 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -112.7 163.42 14.58 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.8 -1.188 . . . . 1.0 109.803 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -70.19 -13.94 62.41 Favored 'General case' 0 N--CA 1.436 -1.142 0 O-C-N 119.726 -1.859 . . . . 1.0 112.895 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.0 m -84.55 -11.84 55.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 125.948 1.699 . . . . 1.0 112.164 171.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -83.43 173.19 11.72 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.449 -2.032 . . . . 1.0 110.721 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 76.9 p -153.48 159.23 32.38 Favored Pre-proline 0 CA--C 1.498 -1.055 0 O-C-N 120.748 -1.22 . . . . 1.0 111.027 -161.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.87 -32.27 95.05 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 C-N-CA 123.616 2.877 . . . . 1.0 115.17 171.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.29 -46.03 78.37 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-O 122.54 1.162 . . . . 1.0 113.59 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -69.58 -40.77 76.53 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 125.424 1.49 . . . . 1.0 113.452 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 16.4 tp -87.74 -8.4 56.09 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.811 -1.18 . . . . 1.0 111.696 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 60.13 48.25 8.59 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 127.5 2.32 . . . . 1.0 114.443 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.66 151.29 25.25 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 127.169 2.188 . . . . 1.0 115.081 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -105.6 175.95 5.32 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.089 1.756 . . . . 1.0 110.518 -175.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -56.26 -26.59 52.18 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 126.297 1.839 . . . . 1.0 115.528 176.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.73 89.69 2.34 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 124.438 1.095 . . . . 1.0 108.826 163.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.86 169.68 12.33 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.187 -1.57 . . . . 1.0 114.283 174.151 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.9 m -130.84 118.07 20.25 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 124.809 1.243 . . . . 1.0 111.012 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 24.2 mm -105.74 140.56 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 127.575 2.35 . . . . 1.0 107.981 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -110.98 142.58 42.92 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 120.445 -1.409 . . . . 1.0 109.2 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.5 139.64 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 O-C-N 120.494 -1.379 . . . . 1.0 109.297 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -123.71 140.67 52.76 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.714 -1.217 . . . . 1.0 107.714 165.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -86.03 133.12 33.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 120.966 -1.084 . . . . 1.0 109.893 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 . . . . . 0 N--CA 1.434 -1.236 0 O-C-N 120.939 -1.101 . . . . 1.0 112.532 -163.632 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 966' ' ' VAL . . . . . 0.418 ' HB ' ' O ' ' A' ' 31' ' ' GLN . 42.0 t . . . . . 0 N--CA 1.435 -1.189 0 CA-C-O 123.765 1.745 . . . . 1.0 110.836 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 967' ' ' ILE . . . . . 0.56 HG21 ' CD2' ' A' ' 32' ' ' PHE . 2.3 mt -113.12 118.43 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 C-N-CA 127.811 2.444 . . . . 1.0 111.432 -167.619 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -102.12 114.24 28.2 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.021 -1.674 . . . . 1.0 109.19 169.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.497 -1.07 0 CA-C-N 121.725 2.057 . . . . 1.0 115.476 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.2 p-80 . . . . . 0 N--CA 1.437 -1.106 0 N-CA-C 118.602 2.816 . . . . 1.0 118.602 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 pt -139.39 160.78 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 C-N-CA 129.43 3.092 . . . . 1.0 107.297 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -111.94 144.86 40.58 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 119.844 -1.785 . . . . 1.0 109.926 165.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.15 156.69 46.94 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 119.361 -2.087 . . . . 1.0 107.071 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 ptpt -125.37 150.67 47.0 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 126.363 1.865 . . . . 1.0 112.833 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -117.55 124.82 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 125.295 1.438 . . . . 1.0 107.88 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.9 130.19 51.87 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-O 122.613 1.196 . . . . 1.0 113.418 -176.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.386 0 C-N-CA 124.823 1.201 . . . . 1.0 113.349 173.945 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.435 -1.179 0 CA-C-O 121.612 0.72 . . . . 1.0 111.973 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -129.17 138.72 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 O-C-N 120.619 -1.301 . . . . 1.0 109.923 176.069 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.75 146.56 46.92 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 124.025 1.869 . . . . 1.0 114.619 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.61 146.39 47.86 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.857 -1.777 . . . . 1.0 107.952 -163.03 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.255 37.5 ttpt -112.04 115.76 29.44 Favored 'General case' 0 CA--C 1.494 -1.188 0 O-C-N 120.482 -1.386 . . . . 1.0 111.822 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.98 154.58 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-O 124.24 1.971 . . . . 1.0 110.972 -160.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.31 158.97 19.55 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.608 -2.087 . . . . 1.0 112.625 -176.006 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ttt-85 -71.31 -38.02 71.77 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 115.817 1.784 . . . . 1.0 115.817 -161.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -91.06 -16.61 27.6 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.769 -1.207 . . . . 1.0 113.571 -178.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 63.8 m -63.37 138.18 97.28 Favored Pre-proline 0 N--CA 1.437 -1.117 0 C-N-CA 125.331 1.452 . . . . 1.0 112.566 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -65.74 156.27 64.85 Favored 'Trans proline' 0 N--CA 1.44 -1.66 0 CA-C-N 124.023 2.473 . . . . 1.0 116.306 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.422 1.8 pp -61.39 -25.62 67.3 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 126.317 1.847 . . . . 1.0 114.006 172.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 93.2 p -52.58 -29.02 23.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.944 -1.722 . . . . 1.0 114.879 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -42.66 77.4 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.5 -2.0 . . . . 1.0 112.73 -174.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.14 -35.44 80.48 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.362 -1.461 . . . . 1.0 113.208 170.207 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.9 ttt -61.42 -41.75 97.66 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.193 -1.567 . . . . 1.0 114.805 173.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.96 -43.03 99.69 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 125.761 1.624 . . . . 1.0 111.989 172.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.73 81.95 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 174.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -59.79 -43.42 94.44 Favored 'General case' 0 N--CA 1.437 -1.112 0 C-N-CA 126.213 1.805 . . . . 1.0 111.662 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.5 m -60.39 -43.41 96.68 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 125.249 1.419 . . . . 1.0 114.174 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.75 -51.55 54.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 114.99 1.478 . . . . 1.0 114.99 174.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -42.29 59.3 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.761 -1.212 . . . . 1.0 113.749 -172.263 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -112.33 0.47 15.7 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 113.053 0.76 . . . . 1.0 113.053 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 41.46 28.52 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 118.093 1.997 . . . . 1.0 118.093 163.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.4 mt -121.58 168.02 12.22 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.282 1.433 . . . . 1.0 111.215 -171.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 t -102.22 133.04 47.74 Favored 'General case' 0 N--CA 1.436 -1.149 0 O-C-N 120.502 -1.374 . . . . 1.0 112.927 176.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 23.8 ptp -66.55 -18.57 65.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.397 1.628 . . . . 1.0 115.397 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -96.59 1.52 51.33 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.613 -1.304 . . . . 1.0 113.061 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -110.37 -31.5 7.27 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 119.722 -1.861 . . . . 1.0 111.769 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.2 pp -115.27 135.25 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 O-C-N 121.615 -0.678 . . . . 1.0 110.661 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -132.75 154.93 49.74 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.137 -1.602 . . . . 1.0 111.329 -171.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.425 ' HB3' HD11 ' A' ' 67' ' ' ILE . 16.9 m-30 -104.17 148.66 26.04 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.297 -1.502 . . . . 1.0 113.055 -166.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -147.34 145.1 29.2 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 125.079 1.352 . . . . 1.0 108.213 -171.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -129.97 110.29 11.55 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 120.615 -1.303 . . . . 1.0 109.026 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 52.57 47.15 25.31 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.757 2.023 . . . . 1.0 114.038 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.93 4.89 86.39 Favored Glycine 0 N--CA 1.435 -1.416 0 O-C-N 120.371 -1.456 . . . . 1.0 116.289 -176.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -114.6 132.2 22.99 Favored Pre-proline 0 N--CA 1.434 -1.238 0 CA-C-N 120.386 2.093 . . . . 1.0 109.08 -177.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.63 135.26 34.05 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 123.869 3.046 . . . . 1.0 115.797 163.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.425 HD11 ' HB3' ' A' ' 60' ' ' PHE . 4.7 pt -119.66 142.85 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 105.943 -1.873 . . . . 1.0 105.943 174.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -100.14 158.25 15.99 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.796 -1.19 . . . . 1.0 108.574 -169.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -66.12 -26.0 67.25 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 119.382 -2.074 . . . . 1.0 113.569 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.3 m -78.48 -12.63 60.02 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 126.215 1.806 . . . . 1.0 113.213 171.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.94 172.64 11.9 Favored 'General case' 0 N--CA 1.432 -1.343 0 O-C-N 118.663 -2.523 . . . . 1.0 111.711 174.316 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 54.4 p -148.11 160.83 36.39 Favored Pre-proline 0 CA--C 1.495 -1.143 0 O-C-N 120.094 -1.629 . . . . 1.0 109.24 -159.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 99.7 Cg_exo -55.83 -36.14 94.9 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.275 2.65 . . . . 1.0 115.909 164.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.45 -45.7 82.72 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 114.124 1.157 . . . . 1.0 114.124 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -71.66 -43.16 66.55 Favored 'General case' 0 N--CA 1.433 -1.299 0 C-N-CA 124.694 1.197 . . . . 1.0 111.886 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -4.56 56.41 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.81 0.814 . . . . 1.0 111.754 -175.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.267 51.2 mt-10 60.02 48.33 8.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 C-N-CA 127.129 2.172 . . . . 1.0 115.106 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.9 mtt -73.64 153.6 40.08 Favored 'General case' 0 N--CA 1.432 -1.335 0 C-N-CA 126.653 1.981 . . . . 1.0 111.675 173.63 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.579 ' HG3' ' H ' ' A' ' 81' ' ' GLU . 10.7 pt-20 -118.14 178.7 4.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 O-C-N 120.568 -1.333 . . . . 1.0 110.606 -168.207 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.259 9.6 p-10 -52.92 -26.55 15.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.987 2.515 . . . . 1.0 116.556 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.579 ' H ' ' HG3' ' A' ' 79' ' ' GLU . 50.9 mt-10 -136.61 66.32 1.48 Allowed 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 125.12 1.368 . . . . 1.0 111.854 167.76 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.73 167.35 19.22 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 116.966 2.21 . . . . 1.0 116.966 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.4 m -127.63 125.38 40.07 Favored 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 126.17 1.788 . . . . 1.0 112.121 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 73.9 mt -114.33 140.76 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 C-N-CA 129.233 3.013 . . . . 1.0 109.172 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -110.9 141.48 44.26 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.965 1.706 . . . . 1.0 106.597 -171.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.7 t -108.54 131.6 58.68 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.257 0 O-C-N 120.783 -1.198 . . . . 1.0 108.82 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -118.46 135.31 54.44 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 123.456 1.598 . . . . 1.0 111.822 164.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.14 140.5 29.4 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 125.414 1.486 . . . . 1.0 111.816 -172.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 . . . . . 0 N--CA 1.435 -1.222 0 O-C-N 121.077 -1.014 . . . . 1.0 111.67 -178.605 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.292 0.2 OUTLIER . . . . . 0 N--CA 1.435 -1.222 0 N-CA-C 116.381 1.993 . . . . 1.0 116.381 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -113.05 115.22 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 124.573 1.149 . . . . 1.0 109.276 -168.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -102.16 122.94 45.13 Favored 'General case' 0 N--CA 1.434 -1.237 0 O-C-N 120.139 -1.6 . . . . 1.0 110.364 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 969' ' ' LEU . . . . . 0.415 ' HA ' HD13 ' B' ' 969' ' ' LEU . 3.2 mm? . . . . . 0 N--CA 1.435 -1.182 0 O-C-N 120.167 -1.583 . . . . 1.0 114.989 -175.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.3 mmt . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 119.9 -0.095 . . . . 1.0 111.144 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.26 -8.31 51.29 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.566 -1.334 . . . . 1.0 111.896 174.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -78.77 159.36 27.94 Favored 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 127.635 2.374 . . . . 1.0 113.801 177.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -93.61 130.56 39.47 Favored 'General case' 0 N--CA 1.433 -1.294 0 O-C-N 120.579 -1.326 . . . . 1.0 109.545 174.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -91.82 129.51 41.94 Favored Pre-proline 0 N--CA 1.435 -1.207 0 O-C-N 120.38 -1.45 . . . . 1.0 112.154 -176.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -53.34 155.93 11.64 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 124.401 3.401 . . . . 1.0 116.425 165.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -157.32 11.18 0.21 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 113.313 0.857 . . . . 1.0 113.313 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.5 120.62 12.04 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 119.908 -1.745 . . . . 1.0 114.277 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.18 5.78 88.68 Favored Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 124.667 1.127 . . . . 1.0 115.682 -175.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.1 t -106.52 117.7 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.105 0 CA-C-N 119.046 1.423 . . . . 1.0 109.022 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -75.81 -47.3 26.28 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-O 123.434 1.588 . . . . 1.0 113.395 -178.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 20.8 p -142.51 142.27 32.23 Favored 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 125.913 1.685 . . . . 1.0 108.949 -175.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -104.25 125.26 50.37 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 121.334 -0.854 . . . . 1.0 109.766 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . 0.307 0.5 OUTLIER 13.22 91.88 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 120.406 3.484 . . . . 1.0 120.406 174.504 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.9 t30 79.85 40.76 0.08 Allowed 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 126.921 2.088 . . . . 1.0 111.893 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 83.93 27.25 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 C-N-CA 126.669 1.987 . . . . 1.0 112.859 161.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -81.76 133.34 35.33 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.544 -1.347 . . . . 1.0 112.609 173.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.9 pt -143.03 160.72 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 C-N-CA 131.29 3.836 . . . . 1.0 106.541 -174.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -116.05 144.85 43.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.769 -2.457 . . . . 1.0 110.566 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.459 HD22 HG21 ' A' ' 34' ' ' ILE . 1.8 pt? -132.25 157.2 44.97 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 119.375 -2.078 . . . . 1.0 106.084 173.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.3 ptpt -122.25 150.0 42.91 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 120.009 -1.682 . . . . 1.0 110.456 168.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.46 126.05 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.01 130.21 53.1 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 122.876 1.322 . . . . 1.0 112.114 -176.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.16 178.84 50.98 Favored Glycine 0 N--CA 1.433 -1.505 0 CA-C-O 123.351 1.528 . . . . 1.0 115.133 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -64.94 -33.6 76.42 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 125.882 1.673 . . . . 1.0 111.445 173.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -90.44 7.49 38.5 Favored 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 125.935 1.694 . . . . 1.0 112.937 -174.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.86 9.4 85.47 Favored Glycine 0 N--CA 1.436 -1.309 0 O-C-N 120.526 -1.359 . . . . 1.0 115.305 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.3 m -86.37 132.73 33.89 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 121.418 -1.048 . . . . 1.0 110.425 176.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -139.84 133.81 36.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.13 0 C-N-CA 124.232 1.013 . . . . 1.0 112.782 -167.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.549 ' CG2' HG21 ' B' ' 966' ' ' VAL . 0.4 OUTLIER -129.19 138.78 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.067 0 O-C-N 120.566 -1.334 . . . . 1.0 110.178 170.174 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.46 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -104.07 158.49 16.39 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 123.406 1.574 . . . . 1.0 112.687 174.483 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.482 ' CD2' HD13 ' B' ' 967' ' ' ILE . 0.1 OUTLIER -145.03 152.49 40.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.725 -1.125 . . . . 1.0 108.099 -173.285 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -124.12 118.3 26.6 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.768 -1.568 . . . . 1.0 106.768 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.568 ' HA ' HD21 ' B' ' 969' ' ' LEU . 12.7 tt -144.49 154.83 14.84 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 C-N-CA 128.247 2.619 . . . . 1.0 111.113 -154.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -102.09 157.11 17.12 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 112.054 -2.339 . . . . 1.0 112.118 -177.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.09 -37.97 78.73 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 115.816 1.784 . . . . 1.0 115.816 -158.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -82.77 -17.97 42.32 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 114.344 1.238 . . . . 1.0 114.344 176.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 31.9 m -61.59 131.75 92.8 Favored Pre-proline 0 N--CA 1.438 -1.032 0 C-N-CA 125.479 1.511 . . . . 1.0 112.148 -175.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.78 157.08 62.96 Favored 'Trans proline' 0 N--CA 1.441 -1.606 0 CA-C-N 124.881 2.779 . . . . 1.0 114.914 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.433 2.7 pp -61.98 -25.55 67.69 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 124.958 1.303 . . . . 1.0 114.484 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.0 p -52.67 -29.02 24.2 Favored 'General case' 0 N--CA 1.435 -1.218 0 O-C-N 119.803 -1.811 . . . . 1.0 114.897 171.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -44.17 65.43 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 119.754 -1.841 . . . . 1.0 111.521 -175.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -35.58 80.0 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.898 -1.126 . . . . 1.0 111.957 175.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 ttm -61.65 -42.09 98.42 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 119.778 -1.826 . . . . 1.0 114.11 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 ttpt -69.14 -37.17 78.15 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.147 -1.595 . . . . 1.0 112.503 175.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.65 83.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 114.238 1.199 . . . . 1.0 114.238 171.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -59.13 -43.31 91.97 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.911 -1.743 . . . . 1.0 111.897 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 81.2 m -62.53 -42.46 99.54 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 125.009 1.323 . . . . 1.0 113.769 175.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.14 -48.89 78.08 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 124.594 1.157 . . . . 1.0 113.754 175.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -78.57 -43.16 27.25 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 114.85 1.426 . . . . 1.0 114.85 -174.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -114.16 9.59 17.18 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.934 -1.104 . . . . 1.0 112.793 -165.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.08 46.99 8.75 Favored Glycine 0 CA--C 1.493 -1.281 0 N-CA-C 117.67 1.828 . . . . 1.0 117.67 161.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.7 mt -125.59 160.95 28.32 Favored 'General case' 0 N--CA 1.436 -1.167 0 C-N-CA 124.566 1.147 . . . . 1.0 109.825 -170.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 m -102.28 133.81 46.59 Favored 'General case' 0 CA--C 1.496 -1.118 0 O-C-N 120.295 -1.503 . . . . 1.0 110.218 172.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -63.74 -32.59 74.13 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 116.527 2.047 . . . . 1.0 116.527 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -78.99 -14.71 59.04 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.19 -1.569 . . . . 1.0 114.024 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -87.73 -16.83 33.14 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.882 -1.136 . . . . 1.0 112.616 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.1 pt -116.37 140.47 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 O-C-N 120.814 -1.179 . . . . 1.0 108.987 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -138.21 146.33 42.49 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 107.265 -1.383 . . . . 1.0 107.265 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.1 m-30 -107.15 148.58 28.66 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.505 1.145 . . . . 1.0 110.663 -170.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -131.98 153.95 49.81 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 124.844 1.258 . . . . 1.0 109.346 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -126.12 108.69 11.57 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 165.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 48.71 50.49 17.21 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.098 2.159 . . . . 1.0 115.371 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.62 6.57 89.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 116.186 1.234 . . . . 1.0 116.186 -177.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -110.62 127.67 26.58 Favored Pre-proline 0 N--CA 1.435 -1.199 0 CA-C-N 119.564 1.682 . . . . 1.0 109.411 176.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -56.13 135.23 68.84 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 123.237 2.624 . . . . 1.0 115.54 166.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.4 pt -119.29 137.6 52.69 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 106.236 -1.764 . . . . 1.0 106.236 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -112.67 163.83 14.08 Favored 'General case' 0 N--CA 1.435 -1.206 0 O-C-N 120.717 -1.239 . . . . 1.0 108.433 -162.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -61.44 -28.3 69.17 Favored 'General case' 0 CA--C 1.497 -1.092 0 O-C-N 118.98 -2.325 . . . . 1.0 115.731 -175.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.1 m -78.51 -13.93 59.6 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 126.086 1.754 . . . . 1.0 112.459 175.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -75.89 168.93 19.12 Favored 'General case' 0 N--CA 1.432 -1.357 0 O-C-N 119.627 -1.92 . . . . 1.0 111.363 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p -151.43 161.72 28.83 Favored Pre-proline 0 CA--C 1.497 -1.081 0 O-C-N 119.878 -1.764 . . . . 1.0 111.047 -154.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -60.4 -31.69 92.98 Favored 'Trans proline' 0 N--CA 1.44 -1.649 0 C-N-CA 123.6 2.867 . . . . 1.0 115.417 168.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.87 -45.5 70.85 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 122.508 1.147 . . . . 1.0 112.65 173.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -70.48 -42.81 70.89 Favored 'General case' 0 N--CA 1.433 -1.295 0 C-N-CA 125.501 1.521 . . . . 1.0 113.729 -177.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 25.9 tp -85.82 -8.46 58.08 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.557 -1.339 . . . . 1.0 113.008 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 67.39 42.63 2.15 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.549 1.539 . . . . 1.0 113.608 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 63.9 mtt -62.3 148.73 44.11 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 127.065 2.146 . . . . 1.0 115.184 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -91.53 176.48 6.53 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.472 1.509 . . . . 1.0 111.431 -178.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.259 12.1 p-10 -58.16 -26.39 62.66 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.437 2.295 . . . . 1.0 114.477 168.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -138.26 79.15 1.72 Allowed 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 125.35 1.46 . . . . 1.0 109.686 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.68 162.44 21.82 Favored 'General case' 0 N--CA 1.437 -1.094 0 O-C-N 120.021 -1.674 . . . . 1.0 112.483 176.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.8 m -131.21 118.57 20.62 Favored 'General case' 0 CA--C 1.496 -1.11 0 C-N-CA 124.297 1.039 . . . . 1.0 110.332 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mm -119.18 140.6 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 C-N-CA 126.828 2.051 . . . . 1.0 108.937 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -111.05 149.45 30.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.281 -1.512 . . . . 1.0 110.989 -170.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.0 t -115.76 139.63 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 O-C-N 120.665 -1.272 . . . . 1.0 110.625 -174.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -121.63 142.87 49.7 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.426 -0.953 . . . . 1.0 108.426 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -89.56 120.29 30.73 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 120.864 -1.147 . . . . 1.0 109.216 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -122.83 134.2 54.41 Favored 'General case' 0 N--CA 1.435 -1.213 0 N-CA-C 114.822 1.415 . . . . 1.0 114.822 -154.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -83.02 114.67 21.43 Favored 'General case' 0 N--CA 1.433 -1.275 0 C-N-CA 125.776 1.63 . . . . 1.0 111.605 177.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.3 t -103.9 -2.82 25.63 Favored 'General case' 0 CA--C 1.497 -1.089 0 O-C-N 120.553 -1.342 . . . . 1.0 114.083 -169.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.01 5.89 88.9 Favored Glycine 0 CA--C 1.494 -1.241 0 O-C-N 119.758 -1.839 . . . . 1.0 116.045 167.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.705 0 N-CA-C 109.227 -1.549 . . . . 1.0 109.227 179.726 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.827 0 N-CA-C 112.137 -0.385 . . . . 1.0 112.137 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 966' ' ' VAL . . . . . 0.549 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.481 0.3 OUTLIER -97.06 -97.77 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 C-N-CA 124.291 1.036 . . . . 1.0 112.635 179.13 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' B' B ' 967' ' ' ILE . . . . . 0.482 HD13 ' CD2' ' A' ' 32' ' ' PHE . 4.9 mt -88.82 116.61 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 O-C-N 119.857 -1.777 . . . . 1.0 113.259 -163.236 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -102.17 109.24 20.88 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 118.903 -2.373 . . . . 1.0 109.132 160.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -99.61 165.2 11.73 Favored 'General case' 0 CA--C 1.498 -1.053 0 O-C-N 119.651 -1.906 . . . . 1.0 114.389 -168.323 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 14.8 t -150.55 141.13 22.57 Favored 'General case' 0 CA--C 1.498 -1.04 0 O-C-N 120.198 -1.564 . . . . 1.0 113.23 170.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 23.6 ptm -153.72 25.49 0.51 Allowed 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 125.427 1.491 . . . . 1.0 110.973 165.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -145.37 7.07 1.13 Allowed 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.875 -1.141 . . . . 1.0 112.253 -162.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . 0.258 40.9 m-20 66.46 153.06 0.07 Allowed 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 123.024 1.392 . . . . 1.0 111.071 -144.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.37 -47.45 73.35 Favored 'General case' 0 N--CA 1.435 -1.218 0 O-C-N 119.484 -2.01 . . . . 1.0 114.717 -169.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.282 29.7 tt0 . . . . . 0 C--O 1.261 1.664 0 O-C-N 119.639 -1.913 . . . . 1.0 114.464 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.0 mtm . . . . . 0 N--CA 1.481 1.115 0 N-CA-C 111.855 0.317 . . . . 1.0 111.855 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.67 -46.47 72.28 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 129.438 3.095 . . . . 1.0 112.816 -16.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 58.97 43.57 17.64 Favored 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 126.739 2.016 . . . . 1.0 115.658 172.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -97.76 5.49 49.12 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.158 -1.589 . . . . 1.0 112.578 -168.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -64.71 152.47 90.04 Favored Pre-proline 0 N--CA 1.435 -1.202 0 C-N-CA 125.532 1.533 . . . . 1.0 115.057 -178.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -41.55 147.06 0.41 Allowed 'Trans proline' 0 N--CA 1.443 -1.498 1 C-N-CA 125.546 4.164 . . . . 1.0 119.159 168.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -120.2 126.06 49.71 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 124.192 0.997 . . . . 1.0 111.307 -173.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -99.65 -0.91 39.3 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 126.12 1.768 . . . . 1.0 112.651 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 94.62 34.69 6.19 Favored Glycine 0 N--CA 1.435 -1.381 0 O-C-N 120.338 -1.476 . . . . 1.0 114.577 174.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.9 t -77.3 116.91 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.137 0 O-C-N 121.296 -1.12 . . . . 1.0 109.367 171.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -120.58 -10.0 9.3 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.911 -1.118 . . . . 1.0 112.111 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.261 19.7 m 52.19 60.07 4.08 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 127.156 2.182 . . . . 1.0 113.146 176.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -98.3 106.06 18.29 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 120.91 -1.119 . . . . 1.0 110.579 -167.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -83.8 -33.54 24.93 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.774 -1.204 . . . . 1.0 112.285 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -62.94 150.24 42.64 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 115.926 1.824 . . . . 1.0 115.926 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.65 25.92 1.49 Allowed 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 126.982 2.113 . . . . 1.0 111.646 164.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -99.04 136.69 38.63 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.67 1.224 . . . . 1.0 109.271 172.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.7 pt -139.38 160.7 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 126.461 1.904 . . . . 1.0 107.282 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -117.7 144.73 44.98 Favored 'General case' 0 N--CA 1.432 -1.329 0 N-CA-C 106.092 -1.818 . . . . 1.0 106.092 170.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.7 156.06 45.56 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 105.256 -2.128 . . . . 1.0 105.256 168.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -115.72 150.61 36.55 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 125.786 1.635 . . . . 1.0 109.91 169.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.411 HG11 ' CZ ' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -111.28 127.59 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.675 0 N-CA-C 105.719 -1.956 . . . . 1.0 105.719 171.619 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -130.3 130.15 44.14 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.163 0.982 . . . . 1.0 111.581 -174.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.0 -154.31 11.83 Favored Glycine 0 CA--C 1.492 -1.395 0 N-CA-C 108.548 -1.821 . . . . 1.0 108.548 172.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 54.32 54.55 9.3 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 116.385 1.994 . . . . 1.0 116.385 160.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 59.97 40.47 18.84 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 127.941 2.497 . . . . 1.0 113.951 -178.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.09 11.34 65.1 Favored Glycine 0 N--CA 1.436 -1.334 0 O-C-N 119.851 -1.781 . . . . 1.0 114.288 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.0 m -70.31 133.53 47.06 Favored 'General case' 0 CA--C 1.497 -1.086 0 O-C-N 121.292 -1.122 . . . . 1.0 112.021 170.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 p -139.94 139.89 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 C-N-CA 123.904 0.882 . . . . 1.0 112.273 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.258 0.4 OUTLIER -129.25 138.8 53.45 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.083 0 O-C-N 119.636 -1.915 . . . . 1.0 110.531 158.535 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.06 139.54 53.18 Favored 'General case' 0 CA--C 1.494 -1.202 0 CA-C-O 123.425 1.583 . . . . 1.0 113.479 175.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.496 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.1 OUTLIER -144.06 146.86 33.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.745 -1.222 . . . . 1.0 112.963 -165.339 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.269 20.5 ttpt -112.78 115.85 29.15 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.858 1.263 . . . . 1.0 113.371 -166.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.9 154.67 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 123.576 1.655 . . . . 1.0 110.878 -152.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -106.63 165.72 11.09 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 123.298 1.523 . . . . 1.0 114.217 -170.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -62.97 -38.17 90.04 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.193 2.294 . . . . 1.0 117.193 -159.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.28 15.88 21.58 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.536 -1.353 . . . . 1.0 113.764 -178.05 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 16.1 m -84.08 135.93 41.58 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 124.855 1.262 . . . . 1.0 111.723 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.13 152.6 76.19 Favored 'Trans proline' 0 N--CA 1.441 -1.571 0 C-N-CA 123.039 2.492 . . . . 1.0 114.576 173.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.332 3.4 pp -61.88 -25.69 67.7 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 114.405 1.261 . . . . 1.0 114.405 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 83.7 p -52.72 -29.06 24.81 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 119.538 -1.976 . . . . 1.0 116.067 166.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -74.55 -45.88 42.68 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 119.557 -1.965 . . . . 1.0 110.618 -167.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.739 HD13 ' H ' ' A' ' 43' ' ' LEU 0.327 0.0 OUTLIER -68.85 -31.13 69.86 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.695 1.368 . . . . 1.0 114.695 170.233 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 18.4 ttt -61.04 -41.72 97.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.397 -2.065 . . . . 1.0 114.065 173.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -41.52 98.65 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 120.876 -1.14 . . . . 1.0 112.418 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.61 -36.84 81.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.118 1.525 . . . . 1.0 115.118 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -58.94 -43.86 91.28 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 120.025 -1.672 . . . . 1.0 112.185 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.2 m -62.3 -42.36 99.3 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.009 1.324 . . . . 1.0 113.02 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -67.19 -51.52 52.51 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 113.464 0.913 . . . . 1.0 113.464 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.7 -40.68 72.72 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 115.067 1.506 . . . . 1.0 115.067 -174.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -111.13 9.82 21.94 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.915 -1.116 . . . . 1.0 112.513 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.34 Favored Glycine 0 CA--C 1.493 -1.303 0 N-CA-C 115.871 1.108 . . . . 1.0 115.871 164.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.3 mt -116.92 160.41 20.95 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.73 -0.865 . . . . 1.0 111.725 -169.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.0 m -102.23 134.5 45.41 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 121.073 -1.017 . . . . 1.0 109.071 175.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 tpp -61.4 -37.91 85.16 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 127.276 2.23 . . . . 1.0 114.08 -165.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -95.82 1.38 53.12 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.481 -0.781 . . . . 1.0 112.072 -176.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -102.15 -3.98 26.58 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.342 1.057 . . . . 1.0 111.694 177.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.9 pt -123.33 146.12 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 124.471 1.108 . . . . 1.0 108.991 168.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -138.26 148.78 45.07 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 120.65 -1.281 . . . . 1.0 107.682 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.411 ' CZ ' HG11 ' A' ' 22' ' ' VAL . 20.2 m-30 -103.32 147.54 26.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 122.757 1.265 . . . . 1.0 111.854 -176.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -131.19 161.19 32.74 Favored 'General case' 0 N--CA 1.433 -1.317 0 C-N-CA 125.809 1.643 . . . . 1.0 108.135 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -138.57 124.12 19.58 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 107.615 -1.254 . . . . 1.0 107.615 165.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.4 t0 58.54 32.53 22.23 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.591 1.556 . . . . 1.0 114.859 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.42 8.47 87.53 Favored Glycine 0 N--CA 1.435 -1.382 0 O-C-N 119.953 -1.717 . . . . 1.0 116.104 -173.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -117.14 142.14 29.58 Favored Pre-proline 0 N--CA 1.434 -1.234 0 CA-C-N 119.028 1.414 . . . . 1.0 108.481 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -74.7 142.4 28.82 Favored 'Trans proline' 0 C--N 1.307 -1.617 0 CA-C-N 123.286 2.209 . . . . 1.0 112.271 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 pt -116.83 143.84 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 N-CA-C 106.571 -1.64 . . . . 1.0 106.571 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -89.52 154.69 19.81 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 119.592 -1.943 . . . . 1.0 109.815 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -61.06 -27.71 68.54 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 118.845 -2.409 . . . . 1.0 115.217 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 m -95.51 5.64 51.02 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 124.218 1.007 . . . . 1.0 111.758 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -74.56 174.89 8.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.256 -2.153 . . . . 1.0 110.36 165.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.9 p -150.41 163.29 24.73 Favored Pre-proline 0 CA--C 1.498 -1.028 0 O-C-N 119.375 -2.078 . . . . 1.0 112.556 -153.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -57.48 -33.86 97.07 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 123.857 3.038 . . . . 1.0 116.253 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.8 -44.75 69.42 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 122.499 1.143 . . . . 1.0 113.027 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.51 -43.96 79.61 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 124.839 1.255 . . . . 1.0 113.334 -178.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.3 tp -90.83 -8.42 49.62 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.901 -1.124 . . . . 1.0 112.58 -178.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 62.29 44.96 7.09 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 126.794 2.038 . . . . 1.0 114.532 -178.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.6 mtt -59.41 151.32 24.11 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 127.074 2.149 . . . . 1.0 112.868 171.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -120.58 177.76 4.94 Favored 'General case' 0 N--CA 1.432 -1.333 0 O-C-N 121.213 -0.93 . . . . 1.0 109.073 -170.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -56.74 -26.77 57.94 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 127.695 2.398 . . . . 1.0 115.426 -175.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -136.07 83.21 1.99 Allowed 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 123.872 0.869 . . . . 1.0 109.101 162.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.4 166.36 19.48 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 120.121 -1.612 . . . . 1.0 114.581 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 m -132.58 118.42 19.18 Favored 'General case' 0 CA--C 1.496 -1.13 0 C-N-CA 124.503 1.121 . . . . 1.0 110.925 173.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.7 mm -108.64 140.94 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 C-N-CA 129.502 3.121 . . . . 1.0 109.595 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -110.83 134.33 52.61 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 119.465 -2.022 . . . . 1.0 107.615 -164.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 t -110.95 126.71 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-O 121.643 0.735 . . . . 1.0 109.339 -173.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -116.43 143.08 46.02 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-O 122.201 1.0 . . . . 1.0 110.836 170.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -88.16 139.82 30.11 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.547 -1.346 . . . . 1.0 112.703 -175.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -136.09 167.43 21.26 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.385 1.074 . . . . 1.0 109.769 -174.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -131.26 120.8 23.72 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 120.99 -1.069 . . . . 1.0 110.501 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 12.0 t -160.79 157.73 27.31 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 105.344 -2.095 . . . . 1.0 105.344 168.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -112.15 -20.61 6.63 Favored Glycine 0 N--CA 1.437 -1.296 0 O-C-N 120.738 -1.226 . . . . 1.0 113.185 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.788 0 O-C-N 121.225 -1.162 . . . . 1.0 112.906 -179.625 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.865 0 N-CA-C 113.536 0.174 . . . . 1.0 113.536 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 12.4 t -75.0 -60.79 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.162 0 CA-C-O 124.023 1.868 . . . . 1.0 111.57 -177.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 967' ' ' ILE . . . . . 0.496 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 8.4 mt -113.13 124.81 70.14 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.27 0 C-N-CA 127.327 2.251 . . . . 1.0 111.13 -168.05 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -102.1 125.41 48.78 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 106.424 -1.695 . . . . 1.0 106.424 163.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.77 153.53 39.95 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 119.298 3.073 . . . . 1.0 119.298 -157.077 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 13.7 t -123.73 169.56 11.39 Favored 'General case' 0 N--CA 1.437 -1.083 0 N-CA-C 106.217 -1.772 . . . . 1.0 106.217 161.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 4.2 ttt 84.89 26.46 0.07 Allowed 'General case' 0 CA--C 1.498 -1.039 0 C-N-CA 127.844 2.458 . . . . 1.0 107.398 -154.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -158.98 149.44 19.64 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.495 1.518 . . . . 1.0 107.477 -163.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -147.38 28.24 0.99 Allowed 'General case' 0 N--CA 1.434 -1.256 0 CA-C-O 122.894 1.33 . . . . 1.0 110.524 165.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -94.74 3.09 55.46 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 124.327 1.051 . . . . 1.0 109.097 172.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.359 25.8 tt0 . . . . . 0 C--O 1.261 1.67 1 C-N-CA 132.504 4.322 . . . . 1.0 118.888 172.039 . . . . . . . . 2 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 112.598 0.592 . . . . 1.0 112.598 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.88 -43.94 91.29 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 114.846 1.424 . . . . 1.0 114.846 173.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 43.42 54.95 5.05 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 118.476 2.769 . . . . 1.0 118.476 169.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . 0.274 15.9 tp10 74.9 123.83 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 126.168 1.787 . . . . 1.0 113.954 -178.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.6 tttp -64.6 130.5 94.76 Favored Pre-proline 0 N--CA 1.435 -1.2 0 C-N-CA 125.902 1.681 . . . . 1.0 113.756 -170.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_exo -57.79 121.45 10.04 Favored 'Trans proline' 0 N--CA 1.441 -1.601 0 C-N-CA 123.534 2.823 . . . . 1.0 115.875 169.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -77.62 -36.25 51.86 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.929 1.292 . . . . 1.0 114.131 176.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -70.18 -39.19 75.4 Favored 'General case' 0 N--CA 1.434 -1.237 0 O-C-N 120.356 -1.465 . . . . 1.0 114.081 -176.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.22 -14.53 81.58 Favored Glycine 0 CA--C 1.494 -1.259 0 N-CA-C 117.043 1.577 . . . . 1.0 117.043 -170.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.74 142.73 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 C-N-CA 124.621 1.168 . . . . 1.0 110.613 -177.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -128.59 156.0 44.04 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.239 -1.538 . . . . 1.0 109.776 176.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.4 p -99.42 12.66 35.75 Favored 'General case' 0 N--CA 1.437 -1.081 0 C-N-CA 124.929 1.292 . . . . 1.0 113.242 -167.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -59.41 138.78 57.54 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 115.303 1.594 . . . . 1.0 115.303 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.76 -33.16 75.03 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 126.986 2.114 . . . . 1.0 112.505 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -104.99 66.5 0.76 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 124.736 1.214 . . . . 1.0 112.497 174.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -145.54 133.74 21.64 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 106.254 -1.758 . . . . 1.0 106.254 168.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -65.0 161.8 17.96 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 116.176 1.917 . . . . 1.0 116.176 -179.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 37.0 pt -138.86 160.74 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 126.145 1.778 . . . . 1.0 108.556 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -117.76 144.91 44.87 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 119.179 -2.201 . . . . 1.0 108.035 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 34' ' ' ILE . 1.6 pt? -127.43 157.09 40.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 119.219 -2.175 . . . . 1.0 105.433 169.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -120.41 150.6 40.53 Favored 'General case' 0 N--CA 1.432 -1.369 0 O-C-N 119.498 -2.001 . . . . 1.0 111.482 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -118.44 122.1 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 N-CA-C 106.023 -1.843 . . . . 1.0 106.023 177.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.13 131.64 54.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.543 1.137 . . . . 1.0 111.631 -169.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -163.04 -137.9 2.29 Favored Glycine 0 N--CA 1.434 -1.45 0 N-CA-C 109.465 -1.454 . . . . 1.0 109.465 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 43.42 45.14 5.23 Favored 'General case' 0 N--CA 1.436 -1.129 0 C-N-CA 128.005 2.522 . . . . 1.0 117.759 162.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 64.28 30.28 13.49 Favored 'General case' 0 N--CA 1.436 -1.167 0 C-N-CA 126.774 2.03 . . . . 1.0 113.61 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.6 19.01 7.64 Favored Glycine 0 N--CA 1.436 -1.306 0 O-C-N 120.891 -1.13 . . . . 1.0 114.557 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.3 m -115.47 144.99 43.02 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-N 119.504 1.652 . . . . 1.0 111.993 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -139.83 144.77 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 C-N-CA 124.247 1.019 . . . . 1.0 111.563 -167.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.42 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.256 0.5 OUTLIER -129.14 138.68 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 O-C-N 120.355 -1.466 . . . . 1.0 110.88 168.35 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.01 144.98 46.23 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 124.911 2.291 . . . . 1.0 113.963 -175.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.405 ' CD2' HD13 ' B' ' 967' ' ' ILE . 0.3 OUTLIER -132.96 140.66 47.92 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.806 -1.809 . . . . 1.0 107.338 -165.655 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -108.47 118.51 36.96 Favored 'General case' 0 N--CA 1.434 -1.258 0 C-N-CA 126.415 1.886 . . . . 1.0 111.78 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.515 ' HB ' HD11 ' B' ' 969' ' ' LEU . 9.2 tt -147.91 154.73 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.351 0 CA-C-O 124.954 2.311 . . . . 1.0 110.646 -148.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -117.27 160.29 21.33 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 112.511 -2.131 . . . . 1.0 111.84 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -62.15 -38.13 87.83 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 117.4 2.37 . . . . 1.0 117.4 -159.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -74.49 -25.14 59.19 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.346 -1.471 . . . . 1.0 114.36 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.7 m -62.69 127.76 90.79 Favored Pre-proline 0 N--CA 1.436 -1.134 0 C-N-CA 125.885 1.674 . . . . 1.0 114.5 -172.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -69.81 158.47 56.79 Favored 'Trans proline' 0 N--CA 1.441 -1.582 0 C-N-CA 122.895 2.397 . . . . 1.0 113.986 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.439 2.8 pp -59.34 -25.48 64.24 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 114.565 1.32 . . . . 1.0 114.565 177.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 t -52.71 -29.03 24.55 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 120.154 -1.592 . . . . 1.0 113.738 171.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -43.28 88.38 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 119.959 -1.713 . . . . 1.0 113.24 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.43 HD13 ' H ' ' A' ' 43' ' ' LEU 0.421 0.0 OUTLIER -70.31 -31.22 68.45 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 171.169 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.6 tpp -60.22 -45.92 91.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 O-C-N 120.466 -1.396 . . . . 1.0 113.132 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -43.88 98.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 120.909 -1.12 . . . . 1.0 112.552 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.22 79.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.07 1.137 . . . . 1.0 114.07 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -62.7 -44.16 96.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 120.395 -1.44 . . . . 1.0 111.781 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.0 m -62.93 -41.86 99.62 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.731 1.213 . . . . 1.0 114.095 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -68.19 -51.32 47.02 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.984 -1.697 . . . . 1.0 114.868 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.406 ' HD2' HG23 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -72.63 -43.17 63.6 Favored 'General case' 0 CA--C 1.496 -1.116 0 O-C-N 120.049 -1.657 . . . . 1.0 113.749 -173.764 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -112.46 6.97 18.89 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 123.84 0.856 . . . . 1.0 113.036 -170.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.63 3.04 89.86 Favored Glycine 0 N--CA 1.437 -1.247 0 N-CA-C 118.631 2.212 . . . . 1.0 118.631 162.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.18 166.46 23.21 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.746 1.758 . . . . 1.0 115.746 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.1 m -102.25 129.42 48.65 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.549 -1.344 . . . . 1.0 110.455 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -66.55 -21.24 66.16 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 115.681 1.734 . . . . 1.0 115.681 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ptt-85 -77.85 -17.88 56.89 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.75 -1.219 . . . . 1.0 113.462 176.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -94.79 -16.82 22.68 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.392 1.077 . . . . 1.0 112.353 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.5 pt -119.98 141.2 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.2 0 C-N-CA 124.647 1.179 . . . . 1.0 110.251 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 154.94 49.04 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 107.001 -1.481 . . . . 1.0 107.001 171.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -113.2 148.67 34.99 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 122.302 1.049 . . . . 1.0 110.98 -171.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 41.2 ptt180 -137.51 158.15 45.01 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.753 -1.217 . . . . 1.0 111.525 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -137.52 121.2 17.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.51 -0.922 . . . . 1.0 108.51 174.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t70 56.4 40.35 29.74 Favored 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 126.223 1.809 . . . . 1.0 112.99 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.52 3.43 86.48 Favored Glycine 0 N--CA 1.438 -1.205 0 O-C-N 120.095 -1.628 . . . . 1.0 116.273 -176.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -116.65 139.76 25.93 Favored Pre-proline 0 N--CA 1.435 -1.189 0 CA-C-N 119.548 1.674 . . . . 1.0 110.493 -172.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.65 142.64 32.74 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.78 2.32 . . . . 1.0 112.84 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 pt -117.82 147.07 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 C-N-CA 125.439 1.496 . . . . 1.0 108.849 -178.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -109.18 160.58 15.97 Favored 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 120.755 -1.216 . . . . 1.0 110.849 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -69.84 -14.28 62.67 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 119.157 -2.214 . . . . 1.0 114.969 -177.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 95.8 m -99.34 0.46 42.95 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 124.849 1.26 . . . . 1.0 111.714 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -76.75 168.95 19.19 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 118.275 -2.766 . . . . 1.0 109.87 161.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 p -152.77 163.62 22.94 Favored Pre-proline 0 CA--C 1.497 -1.09 0 O-C-N 119.69 -1.881 . . . . 1.0 111.035 -155.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -58.4 -32.87 97.19 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 123.516 2.811 . . . . 1.0 115.781 167.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.82 -45.96 55.66 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 122.123 0.963 . . . . 1.0 112.57 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -66.86 -40.66 87.95 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 125.676 1.591 . . . . 1.0 113.423 -176.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -88.24 -8.34 55.41 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 121.123 -0.986 . . . . 1.0 112.272 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 62.88 48.21 4.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 126.501 1.92 . . . . 1.0 113.65 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.4 mtt -61.19 154.2 23.99 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.727 2.011 . . . . 1.0 112.792 170.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -114.26 -178.4 3.36 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 -172.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.39 10.2 p-10 -55.05 -26.61 38.69 Favored 'General case' 0 N--CA 1.435 -1.225 0 N-CA-C 116.654 2.094 . . . . 1.0 116.654 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -141.27 73.04 1.4 Allowed 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 125.469 1.508 . . . . 1.0 110.27 174.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.19 164.9 24.54 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 116.077 1.881 . . . . 1.0 116.077 -174.589 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.1 m -131.77 115.39 15.91 Favored 'General case' 0 CA--C 1.495 -1.149 0 C-N-CA 124.439 1.096 . . . . 1.0 111.361 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.4 mm -117.9 140.68 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 C-N-CA 126.84 2.056 . . . . 1.0 108.745 -175.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.92 145.7 37.87 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.139 -1.601 . . . . 1.0 110.02 -166.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.6 t -108.56 135.21 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 124.297 1.039 . . . . 1.0 109.014 -177.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -121.83 136.35 54.93 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 122.678 1.228 . . . . 1.0 109.637 164.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -87.93 132.56 34.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 124.268 1.027 . . . . 1.0 110.413 -173.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 96.8 mm-40 -93.07 176.4 6.43 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 115.593 1.701 . . . . 1.0 115.593 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -112.65 11.48 19.58 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 125.623 1.569 . . . . 1.0 111.014 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 20.4 m -65.23 117.73 8.22 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.769 2.028 . . . . 1.0 114.45 -173.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.71 146.59 49.68 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 115.756 1.062 . . . . 1.0 115.756 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.736 0 O-C-N 121.713 -0.875 . . . . 1.0 111.035 179.868 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 CA-C-O 120.128 -0.262 . . . . 1.0 113.211 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 966' ' ' VAL . . . . . 0.42 HG21 ' CG2' ' A' ' 30' ' ' VAL . 0.3 OUTLIER -74.95 -47.22 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 CA-C-N 119.224 1.512 . . . . 1.0 113.964 171.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 967' ' ' ILE . . . . . 0.43 HG22 HD23 ' B' ' 969' ' ' LEU . 4.7 mt -112.43 116.32 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-O 121.993 0.901 . . . . 1.0 109.715 -169.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.07 103.68 14.27 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 120.463 -1.398 . . . . 1.0 108.803 174.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.515 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.5 OUTLIER -107.97 151.65 25.52 Favored 'General case' 0 CA--C 1.497 -1.071 0 O-C-N 119.731 -1.856 . . . . 1.0 115.077 -171.875 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 40.8 p -88.73 -106.66 0.08 Allowed 'General case' 0 N--CA 1.437 -1.108 0 O-C-N 120.498 -1.376 . . . . 1.0 112.312 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.259 0.3 OUTLIER 78.59 -45.98 0.4 Allowed 'General case' 0 CA--C 1.495 -1.164 0 C-N-CA 128.234 2.613 . . . . 1.0 116.49 173.729 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -153.91 163.76 39.52 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 106.392 -1.707 . . . . 1.0 106.392 -161.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 973' ' ' ASP . . . . . 0.45 ' CG ' ' H ' ' B' ' 974' ' ' GLU . 6.8 t70 50.69 -146.76 0.42 Allowed 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 123.533 1.635 . . . . 1.0 114.323 175.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 974' ' ' GLU . . . . . 0.45 ' H ' ' CG ' ' B' ' 973' ' ' ASP . 77.2 mt-10 -135.37 -25.95 1.29 Allowed 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 126.755 2.022 . . . . 1.0 110.53 -173.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.26 1.656 0 C-N-CA 126.785 2.034 . . . . 1.0 116.166 -176.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.8 mtt . . . . . 0 N--CA 1.483 1.181 0 CA-C-O 121.127 0.489 . . . . 1.0 112.119 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.08 -42.99 96.77 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.079 1.352 . . . . 1.0 114.321 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -110.52 124.03 51.04 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 106.002 -1.851 . . . . 1.0 106.002 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -146.94 70.38 1.2 Allowed 'General case' 0 N--CA 1.436 -1.154 0 O-C-N 120.199 -1.563 . . . . 1.0 111.963 -170.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -64.72 143.82 98.76 Favored Pre-proline 0 N--CA 1.435 -1.19 0 O-C-N 120.515 -1.366 . . . . 1.0 114.288 171.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -55.85 136.46 74.69 Favored 'Trans proline' 0 N--CA 1.441 -1.559 0 C-N-CA 124.063 3.176 . . . . 1.0 117.308 168.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -158.51 174.87 14.43 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 118.982 0.81 . . . . 1.0 110.365 177.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -61.51 149.16 39.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 116.747 2.129 . . . . 1.0 116.747 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 60.08 -176.31 3.68 Favored Glycine 0 N--CA 1.438 -1.232 0 N-CA-C 117.727 1.851 . . . . 1.0 117.727 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.7 t -96.38 124.79 49.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.183 0 O-C-N 120.631 -1.511 . . . . 1.0 109.928 -172.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -58.82 142.71 49.59 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 116.282 1.956 . . . . 1.0 116.282 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 91.4 m -82.64 94.86 7.64 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 120.612 -1.305 . . . . 1.0 108.761 168.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -149.83 121.92 8.29 Favored 'General case' 0 N--CA 1.433 -1.282 0 C-N-CA 124.8 1.24 . . . . 1.0 108.247 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 53.89 48.01 22.23 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 126.664 1.985 . . . . 1.0 114.355 -176.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -121.07 156.34 32.45 Favored 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 124.473 1.109 . . . . 1.0 110.181 -174.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -98.48 -6.87 29.5 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.485 -1.384 . . . . 1.0 113.146 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -84.12 153.99 23.41 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.833 2.453 . . . . 1.0 112.64 165.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.8 pt -133.4 160.74 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.296 0 C-N-CA 129.47 3.108 . . . . 1.0 106.173 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.0 m-20 -113.12 144.81 42.01 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 118.885 -2.385 . . . . 1.0 108.185 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.837 HD22 HG21 ' A' ' 34' ' ' ILE . 1.3 pt? -128.37 155.91 43.95 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 105.967 -1.864 . . . . 1.0 105.967 171.111 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.425 ' HD3' HG21 ' A' ' 29' ' ' VAL . 12.9 ptpt -123.87 150.6 44.42 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 120.495 -1.378 . . . . 1.0 111.968 172.198 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -118.93 119.25 60.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.178 0 N-CA-C 108.038 -1.097 . . . . 1.0 108.038 177.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.44 130.22 54.23 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 122.389 1.09 . . . . 1.0 113.268 -165.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.38 175.16 31.61 Favored Glycine 0 N--CA 1.433 -1.523 0 CA-C-O 122.882 1.268 . . . . 1.0 111.991 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -76.68 -13.6 60.03 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.388 1.255 . . . . 1.0 114.388 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -88.15 16.64 5.9 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.683 -1.26 . . . . 1.0 113.2 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.63 4.96 89.48 Favored Glycine 0 CA--C 1.493 -1.314 0 O-C-N 120.272 -1.518 . . . . 1.0 115.542 170.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.5 m -119.7 143.43 47.76 Favored 'General case' 0 CA--C 1.492 -1.283 0 CA-C-O 124.777 2.227 . . . . 1.0 111.727 170.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.425 HG21 ' HD3' ' A' ' 21' ' ' LYS . 1.6 p -139.95 147.07 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-N 110.56 -3.018 . . . . 1.0 106.715 -168.21 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.738 HG22 HG11 ' B' ' 966' ' ' VAL . 0.8 OUTLIER -121.4 133.34 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 O-C-N 120.931 -1.105 . . . . 1.0 109.027 170.761 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.417 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -99.3 160.84 13.98 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.54 3.067 . . . . 1.0 114.583 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -145.1 140.54 28.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.297 -2.127 . . . . 1.0 105.526 -175.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -100.22 117.77 35.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 C-N-CA 127.317 2.247 . . . . 1.0 107.657 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.837 HG21 HD22 ' A' ' 20' ' ' LEU . 12.3 tt -146.1 154.87 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.281 0 C-N-CA 127.937 2.495 . . . . 1.0 111.33 -151.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.73 167.54 13.34 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 113.595 -1.638 . . . . 1.0 113.705 -174.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -66.57 -38.21 86.59 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 116.989 2.218 . . . . 1.0 116.989 -162.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -87.11 -27.78 22.9 Favored 'General case' 0 CA--C 1.494 -1.175 0 O-C-N 120.2 -1.562 . . . . 1.0 111.226 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.6 m -57.75 111.99 4.19 Favored Pre-proline 0 N--CA 1.436 -1.13 0 C-N-CA 127.834 2.454 . . . . 1.0 113.686 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -67.47 163.19 35.75 Favored 'Trans proline' 0 N--CA 1.441 -1.607 0 C-N-CA 124.055 3.17 . . . . 1.0 116.081 -172.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.45 2.5 pp -64.74 -25.59 68.0 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.087 1.514 . . . . 1.0 115.087 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 97.3 p -52.68 -29.1 24.68 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.876 -1.765 . . . . 1.0 114.915 168.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.18 -43.92 80.96 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.214 -1.554 . . . . 1.0 112.094 -177.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.424 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -68.4 -35.59 77.88 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.555 -1.341 . . . . 1.0 113.568 171.635 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.3 ttm -60.59 -43.65 97.14 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.318 -1.488 . . . . 1.0 114.207 176.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -66.72 -39.44 88.02 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.517 -1.364 . . . . 1.0 112.971 174.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.91 82.66 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.249 -1.532 . . . . 1.0 114.392 177.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -58.54 -43.85 89.39 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 126.542 1.937 . . . . 1.0 110.863 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.9 m -62.01 -41.75 98.42 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 120.332 -1.48 . . . . 1.0 114.055 174.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -67.15 -47.71 70.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 114.707 1.373 . . . . 1.0 114.707 175.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -73.14 -43.25 61.89 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 115.892 1.812 . . . . 1.0 115.892 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -112.49 4.17 17.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 121.611 -0.68 . . . . 1.0 112.051 -164.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.49 24.37 47.03 Favored Glycine 0 CA--C 1.494 -1.272 0 N-CA-C 117.403 1.721 . . . . 1.0 117.403 159.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.3 mt -103.7 166.88 10.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 124.773 1.229 . . . . 1.0 112.733 -171.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.9 m -101.91 133.19 47.07 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 120.552 -1.342 . . . . 1.0 110.08 171.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 20.5 ptp -66.45 -25.42 66.72 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 115.499 1.666 . . . . 1.0 115.499 -170.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 -87.05 -1.62 58.01 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.281 -1.512 . . . . 1.0 112.783 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -102.82 -4.73 24.47 Favored 'General case' 0 N--CA 1.433 -1.297 0 O-C-N 120.893 -1.129 . . . . 1.0 111.792 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.6 pt -118.95 142.37 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 O-C-N 120.69 -1.256 . . . . 1.0 111.326 175.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -138.16 143.85 40.48 Favored 'General case' 0 N--CA 1.434 -1.268 0 O-C-N 120.246 -1.534 . . . . 1.0 107.542 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -105.65 145.16 31.39 Favored 'General case' 0 N--CA 1.433 -1.318 0 O-C-N 121.102 -0.999 . . . . 1.0 109.346 -175.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -120.84 152.61 38.18 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.462 1.125 . . . . 1.0 109.838 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -127.99 119.23 25.05 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.261 -1.755 . . . . 1.0 106.261 162.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.8 t70 52.68 45.99 27.59 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.075 1.35 . . . . 1.0 113.615 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.73 3.92 87.58 Favored Glycine 0 N--CA 1.435 -1.406 0 N-CA-C 117.823 1.889 . . . . 1.0 117.823 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -121.38 144.63 40.47 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 120.762 2.281 . . . . 1.0 109.039 176.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -68.04 149.65 77.17 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 122.785 2.03 . . . . 1.0 113.701 176.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.9 pt -116.84 141.97 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.258 0 N-CA-C 106.012 -1.847 . . . . 1.0 106.012 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -112.64 171.26 7.63 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 120.481 -1.387 . . . . 1.0 109.842 -162.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -73.53 -16.77 61.27 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.428 -2.045 . . . . 1.0 113.131 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.7 m -83.54 -13.88 53.51 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 125.15 1.38 . . . . 1.0 112.436 167.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -77.36 167.37 21.8 Favored 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.087 -2.258 . . . . 1.0 111.208 168.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.0 p -154.78 160.4 30.95 Favored Pre-proline 0 CA--C 1.496 -1.103 0 O-C-N 120.057 -1.652 . . . . 1.0 109.873 -160.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.1 -41.17 26.91 Favored 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 124.352 3.368 . . . . 1.0 116.328 161.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.09 88.1 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 114.489 1.292 . . . . 1.0 114.489 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -71.42 -38.4 71.4 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.323 1.449 . . . . 1.0 113.014 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 tp -94.57 -1.93 52.43 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 121.088 -1.008 . . . . 1.0 112.905 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 55.29 48.22 19.74 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 126.495 1.918 . . . . 1.0 114.915 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.6 mtt -62.2 144.12 55.89 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 126.136 1.774 . . . . 1.0 113.758 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -92.49 176.33 6.5 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 122.354 1.073 . . . . 1.0 112.473 -174.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.258 9.3 p-10 -56.57 -26.52 55.44 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 127.832 2.453 . . . . 1.0 115.144 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -138.39 75.36 1.52 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 125.185 1.394 . . . . 1.0 108.123 166.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.76 157.22 31.79 Favored 'General case' 0 N--CA 1.436 -1.145 0 O-C-N 119.668 -1.895 . . . . 1.0 113.696 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.9 m -125.62 115.25 19.84 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.905 0.86 . . . . 1.0 110.314 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.3 mm -122.02 140.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.172 0 C-N-CA 127.548 2.339 . . . . 1.0 108.747 -172.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -110.91 147.02 35.52 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.855 -1.778 . . . . 1.0 109.578 -163.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 59.8 t -108.53 129.33 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.22 0 O-C-N 121.002 -1.062 . . . . 1.0 109.865 -175.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -118.71 138.88 52.33 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 122.97 1.367 . . . . 1.0 110.701 163.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -87.19 142.37 27.96 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 121.15 -0.969 . . . . 1.0 112.764 -175.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -134.86 164.32 27.83 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.199 -0.938 . . . . 1.0 110.785 -169.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -131.98 160.49 35.68 Favored 'General case' 0 N--CA 1.435 -1.207 0 C-N-CA 124.539 1.135 . . . . 1.0 109.148 -174.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 41.2 p -136.94 -27.45 1.0 Allowed 'General case' 0 N--CA 1.437 -1.076 0 O-C-N 121.025 -1.047 . . . . 1.0 112.967 178.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.37 8.67 87.62 Favored Glycine 0 N--CA 1.436 -1.33 0 O-C-N 120.024 -1.673 . . . . 1.0 113.565 -169.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.701 0 N-CA-C 108.171 -1.972 . . . . 1.0 108.171 -179.047 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.917 0 N-CA-C 115.076 0.79 . . . . 1.0 115.076 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 966' ' ' VAL . . . . . 0.738 HG11 HG22 ' A' ' 30' ' ' VAL . 31.1 t -96.41 -100.33 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 C-N-CA 124.456 1.102 . . . . 1.0 113.199 -176.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 967' ' ' ILE . . . . . 0.46 HG13 HG12 ' B' ' 966' ' ' VAL . 1.2 mt -94.41 123.94 46.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 O-C-N 121.053 -1.029 . . . . 1.0 108.501 -159.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -101.98 107.1 18.13 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.183 -1.573 . . . . 1.0 107.033 172.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.461 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.3 pp -108.02 153.17 23.49 Favored 'General case' 0 N--CA 1.437 -1.077 0 O-C-N 120.219 -1.55 . . . . 1.0 112.824 -172.379 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 6.4 m -132.57 131.48 41.55 Favored 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 107.266 -1.383 . . . . 1.0 107.266 -173.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 12.8 ttt -149.22 -68.13 0.21 Allowed 'General case' 0 CA--C 1.489 -1.402 0 O-C-N 120.914 -1.116 . . . . 1.0 111.534 177.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -123.27 -75.9 0.59 Allowed 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.522 -0.763 . . . . 1.0 109.548 -165.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.13 140.86 51.94 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 124.648 1.179 . . . . 1.0 112.302 -171.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.33 -43.79 79.38 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 116.308 1.966 . . . . 1.0 116.308 -166.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.252 32.5 tt0 . . . . . 0 N--CA 1.425 -1.702 0 C-N-CA 127.676 2.391 . . . . 1.0 114.022 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 113.622 0.971 . . . . 1.0 113.622 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.02 -45.77 73.08 Favored 'General case' 0 N--CA 1.434 -1.246 0 O-C-N 120.544 -1.348 . . . . 1.0 113.293 167.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -70.48 141.22 52.01 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 124.462 1.105 . . . . 1.0 112.751 174.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -87.79 -39.13 15.14 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.136 -1.603 . . . . 1.0 111.003 171.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -64.74 143.59 98.75 Favored Pre-proline 0 N--CA 1.435 -1.212 0 O-C-N 120.858 -1.151 . . . . 1.0 112.987 175.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -75.31 155.6 41.53 Favored 'Trans proline' 0 N--CA 1.44 -1.649 0 C-N-CA 122.572 2.181 . . . . 1.0 112.186 -175.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -66.16 149.83 49.69 Favored 'General case' 0 N--CA 1.435 -1.225 0 C-N-CA 124.313 1.045 . . . . 1.0 113.491 176.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -124.18 136.8 54.45 Favored 'General case' 0 N--CA 1.434 -1.275 0 C-N-CA 124.39 1.076 . . . . 1.0 110.516 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.27 1.35 90.41 Favored Glycine 0 CA--C 1.493 -1.333 0 O-C-N 120.552 -1.342 . . . . 1.0 114.743 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 66.8 t -68.43 -41.19 83.18 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 C-N-CA 125.087 1.355 . . . . 1.0 110.672 171.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -123.74 -43.04 2.15 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 122.417 1.104 . . . . 1.0 112.215 174.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 54.9 p -153.85 160.71 42.29 Favored 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 125.647 1.579 . . . . 1.0 110.845 -174.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.432 ' H ' ' CD ' ' A' ' 13' ' ' GLU . 0.8 OUTLIER -70.95 150.31 45.81 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 124.991 1.317 . . . . 1.0 113.234 166.319 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -107.76 162.39 14.03 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 124.972 1.309 . . . . 1.0 109.453 -177.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -134.65 115.81 14.23 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.39 -1.444 . . . . 1.0 108.519 178.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -158.92 162.98 36.93 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-O 124.527 2.108 . . . . 1.0 110.976 -177.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -126.71 163.51 23.34 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 129.788 3.235 . . . . 1.0 113.098 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.6 pt -136.37 160.63 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 C-N-CA 128.53 2.732 . . . . 1.0 106.343 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -117.66 144.7 44.96 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 119.641 -1.912 . . . . 1.0 106.589 169.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.47 154.55 51.35 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.392 -1.443 . . . . 1.0 107.142 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -120.0 148.23 43.81 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.071 1.748 . . . . 1.0 111.354 175.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 t -119.98 122.93 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 N-CA-C 107.783 -1.192 . . . . 1.0 107.783 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.57 130.17 55.01 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 124.615 1.166 . . . . 1.0 111.883 -172.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.56 -173.39 33.68 Favored Glycine 0 N--CA 1.437 -1.294 0 CA-C-O 122.746 1.192 . . . . 1.0 114.756 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -75.95 -16.02 60.07 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 120.747 -1.443 . . . . 1.0 114.704 -166.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.1 p30 -100.72 5.07 43.57 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 124.9 1.28 . . . . 1.0 112.352 175.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.05 5.14 87.92 Favored Glycine 0 N--CA 1.436 -1.319 0 C-N-CA 124.885 1.231 . . . . 1.0 115.648 -179.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 m -70.31 132.65 46.01 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 120.74 -1.447 . . . . 1.0 112.248 174.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.3 p -130.01 137.33 56.77 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.16 0 O-C-N 121.166 -0.959 . . . . 1.0 113.421 -170.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -129.26 138.73 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.862 -1.774 . . . . 1.0 110.169 169.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.69 145.88 47.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-O 124.06 1.885 . . . . 1.0 113.77 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.83 141.7 44.73 Favored 'General case' 0 N--CA 1.432 -1.353 0 O-C-N 119.81 -1.806 . . . . 1.0 109.254 -166.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.272 26.7 ttpt -107.05 115.89 30.97 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.552 1.941 . . . . 1.0 113.483 -176.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.52 ' HB ' HD11 ' B' ' 969' ' ' LEU . 6.8 tt -148.86 154.62 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.429 0 CA-C-O 123.994 1.854 . . . . 1.0 109.833 -158.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.305 3.7 mppt? -95.89 165.76 12.12 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.316 -1.765 . . . . 1.0 112.48 -172.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.4 mtm180 -63.49 -38.07 89.72 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 115.847 1.795 . . . . 1.0 115.847 -160.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -85.43 -23.97 27.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.549 -1.344 . . . . 1.0 112.742 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.8 m -59.12 131.79 87.29 Favored Pre-proline 0 N--CA 1.436 -1.148 0 C-N-CA 126.972 2.109 . . . . 1.0 115.062 -169.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.02 162.05 41.61 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 124.097 3.198 . . . . 1.0 115.236 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.384 2.7 pp -66.91 -25.69 66.5 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 124.663 1.185 . . . . 1.0 114.178 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.4 p -52.74 -29.17 25.63 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 120.342 -1.474 . . . . 1.0 114.839 170.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.73 -43.53 65.69 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.212 -1.555 . . . . 1.0 112.32 -172.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.445 HD13 ' H ' ' A' ' 43' ' ' LEU 0.359 0.0 OUTLIER -68.09 -31.13 70.53 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.61 -1.306 . . . . 1.0 114.167 168.624 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 9.7 ttt -61.64 -43.43 98.88 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.535 -1.353 . . . . 1.0 114.001 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -67.47 -36.41 81.1 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 120.41 -1.431 . . . . 1.0 113.554 170.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.51 -34.89 77.78 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 119.411 -2.056 . . . . 1.0 114.323 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.6 -43.06 99.56 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 126.296 1.839 . . . . 1.0 111.914 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 75.4 m -61.51 -43.85 98.13 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.614 -1.304 . . . . 1.0 113.834 171.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -62.35 -51.84 66.02 Favored 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 120.6 -1.313 . . . . 1.0 114.442 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.444 ' HB2' HD11 ' B' ' 967' ' ' ILE . 0.0 OUTLIER -78.47 -43.33 27.39 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 115.132 1.53 . . . . 1.0 115.132 -176.82 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -108.77 4.22 23.43 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 121.206 -0.933 . . . . 1.0 111.448 -166.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.01 4.95 89.74 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 117.896 1.919 . . . . 1.0 117.896 161.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.7 mt -76.63 160.95 28.96 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.742 1.617 . . . . 1.0 113.833 -173.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 m -102.27 131.77 48.63 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 120.426 -1.421 . . . . 1.0 109.138 168.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.9 ptp -66.58 -18.54 65.42 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 116.427 2.01 . . . . 1.0 116.427 -173.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -85.61 -8.92 57.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 120.602 -1.312 . . . . 1.0 114.078 173.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -82.07 -33.25 29.96 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.634 -1.916 . . . . 1.0 112.453 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.6 pt -113.59 152.68 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 C-N-CA 125.279 1.431 . . . . 1.0 111.119 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -137.69 154.92 49.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 O-C-N 120.511 -1.368 . . . . 1.0 108.055 172.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 -111.3 148.56 32.66 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.662 1.22 . . . . 1.0 110.553 -173.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 53.3 mtm180 -130.26 159.28 37.36 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 122.165 0.983 . . . . 1.0 109.454 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -133.8 125.71 29.05 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 163.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 48.35 44.79 20.35 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 126.816 2.046 . . . . 1.0 114.416 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.98 6.83 86.32 Favored Glycine 0 N--CA 1.435 -1.424 0 O-C-N 120.146 -1.596 . . . . 1.0 116.785 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -119.94 148.28 46.27 Favored Pre-proline 0 N--CA 1.436 -1.13 0 CA-C-N 121.14 2.47 . . . . 1.0 109.288 175.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.11 149.72 52.73 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 122.588 2.192 . . . . 1.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.1 pt -120.57 140.41 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 N-CA-C 107.166 -1.42 . . . . 1.0 107.166 174.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.51 164.28 11.75 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.759 -1.213 . . . . 1.0 110.957 -168.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.9 -13.89 60.59 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 119.056 -2.277 . . . . 1.0 113.945 -176.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 m -96.7 1.45 51.01 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 124.6 1.16 . . . . 1.0 111.226 170.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -82.5 172.0 13.5 Favored 'General case' 0 N--CA 1.432 -1.325 0 O-C-N 119.098 -2.251 . . . . 1.0 110.211 171.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.5 p -147.98 162.19 32.02 Favored Pre-proline 0 CA--C 1.498 -1.053 0 O-C-N 119.684 -1.885 . . . . 1.0 112.384 -153.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -56.17 -33.62 90.95 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 123.587 2.858 . . . . 1.0 115.879 166.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.88 -45.96 69.63 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 119.573 1.078 . . . . 1.0 113.541 176.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.26 -38.64 71.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 125.638 1.575 . . . . 1.0 113.63 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -93.27 -8.47 42.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 121.014 -1.053 . . . . 1.0 111.669 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 63.87 43.22 5.51 Favored 'General case' 0 N--CA 1.435 -1.219 0 C-N-CA 126.878 2.071 . . . . 1.0 113.763 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.2 147.0 49.18 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.216 1.807 . . . . 1.0 111.825 175.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -120.41 176.33 5.54 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 108.712 -0.847 . . . . 1.0 108.712 -168.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.276 10.7 p-10 -54.79 -26.54 35.32 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.837 2.055 . . . . 1.0 115.272 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.07 77.19 1.69 Allowed 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.582 1.553 . . . . 1.0 110.073 166.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.69 160.91 22.29 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 119.656 -1.903 . . . . 1.0 114.823 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -133.59 115.57 14.85 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 124.808 1.243 . . . . 1.0 111.059 -178.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.6 mm -120.4 140.72 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.027 0 C-N-CA 127.817 2.447 . . . . 1.0 111.049 -171.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -110.86 137.41 48.55 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.92 -1.738 . . . . 1.0 109.907 -162.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.65 132.21 57.19 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.246 0 O-C-N 120.774 -1.204 . . . . 1.0 109.63 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -120.4 137.3 54.39 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-O 123.135 1.445 . . . . 1.0 110.223 159.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -96.85 120.4 37.11 Favored 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 120.671 -1.268 . . . . 1.0 110.357 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 -80.08 -45.05 18.94 Favored 'General case' 0 N--CA 1.434 -1.268 0 O-C-N 121.124 -0.985 . . . . 1.0 111.831 -174.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 71.02 113.53 0.05 Allowed 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 126.414 1.886 . . . . 1.0 115.529 171.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 37.2 p -121.17 147.68 45.26 Favored 'General case' 0 CA--C 1.494 -1.207 0 O-C-N 120.236 -1.54 . . . . 1.0 110.393 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.14 -14.32 81.92 Favored Glycine 0 N--CA 1.436 -1.308 0 O-C-N 120.745 -1.222 . . . . 1.0 113.156 175.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.764 0 C-N-CA 126.389 1.947 . . . . 1.0 108.92 169.807 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 N-CA-C 114.178 0.431 . . . . 1.0 114.178 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.295 0.2 OUTLIER -74.81 -50.02 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 N-CA-C 115.234 1.568 . . . . 1.0 115.234 -171.707 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 967' ' ' ILE . . . . . 0.444 HD11 ' HB2' ' A' ' 50' ' ' ARG . 6.3 mt -113.12 115.42 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 124.113 0.965 . . . . 1.0 109.699 -171.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -102.15 101.98 12.37 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.715 1.606 . . . . 1.0 110.897 172.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.52 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.9 OUTLIER -108.24 159.44 16.62 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 118.922 2.934 . . . . 1.0 118.922 -168.226 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 37.3 p -85.33 178.08 7.6 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 128.315 2.646 . . . . 1.0 113.002 170.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.309 21.6 ttt 101.45 123.56 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.142 0 C-N-CA 128.87 2.868 . . . . 1.0 112.504 168.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . 0.319 62.2 m-20 53.21 59.7 4.24 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 126.087 1.755 . . . . 1.0 112.392 -163.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -78.38 78.93 4.84 Favored 'General case' 0 N--CA 1.432 -1.369 0 C-N-CA 125.743 1.617 . . . . 1.0 114.409 -167.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -86.9 48.01 1.58 Allowed 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 125.754 1.622 . . . . 1.0 110.167 158.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 . . . . . 0 C--O 1.26 1.637 0 C-N-CA 128.946 2.898 . . . . 1.0 115.581 -172.929 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.6 mmt . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 113.502 0.927 . . . . 1.0 113.502 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.51 -20.67 60.6 Favored 'General case' 0 N--CA 1.434 -1.265 0 O-C-N 120.952 -1.092 . . . . 1.0 113.396 176.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -119.42 134.29 55.29 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 124.779 1.231 . . . . 1.0 109.915 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -64.27 146.79 53.77 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.352 1.461 . . . . 1.0 111.683 169.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.412 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 63.8 pttt -64.64 145.97 98.5 Favored Pre-proline 0 N--CA 1.436 -1.154 0 N-CA-C 115.272 1.582 . . . . 1.0 115.272 -170.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 5' ' ' LYS . 53.3 Cg_exo -59.15 161.7 15.65 Favored 'Trans proline' 0 N--CA 1.443 -1.489 0 C-N-CA 123.912 3.075 . . . . 1.0 117.737 -171.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -62.22 -43.99 97.58 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 114.389 1.255 . . . . 1.0 114.389 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -99.8 5.38 45.54 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.63 -1.294 . . . . 1.0 112.307 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 69.74 168.45 6.47 Favored Glycine 0 N--CA 1.436 -1.314 0 N-CA-C 117.335 1.694 . . . . 1.0 117.335 176.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.3 p -66.77 133.24 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 125.058 1.343 . . . . 1.0 114.415 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -110.67 20.31 17.77 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 125.309 1.444 . . . . 1.0 112.635 -171.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.4 p -59.55 151.04 25.36 Favored 'General case' 0 CA--C 1.496 -1.1 0 C-N-CA 126.542 1.937 . . . . 1.0 115.146 176.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -92.57 137.05 32.7 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.927 -1.108 . . . . 1.0 112.069 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -141.02 147.06 38.07 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 120.628 -1.295 . . . . 1.0 107.866 172.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -176.18 33.0 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 113.191 0.812 . . . . 1.0 113.191 -163.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -142.43 141.69 32.26 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 105.844 -1.91 . . . . 1.0 105.844 -178.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.4 p-80 -50.34 140.16 13.92 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 117.272 2.323 . . . . 1.0 117.272 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.2 pt -133.26 160.82 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.3 0 C-N-CA 128.732 2.813 . . . . 1.0 107.38 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -110.09 144.92 37.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 O-C-N 118.988 -2.32 . . . . 1.0 108.441 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.71 HD22 HG21 ' A' ' 34' ' ' ILE . 1.5 pt? -127.13 149.79 49.79 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.678 -1.889 . . . . 1.0 106.384 169.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -117.71 148.83 41.64 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 119.74 -1.85 . . . . 1.0 110.629 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.4 t -117.3 127.95 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.271 0 N-CA-C 107.127 -1.434 . . . . 1.0 107.127 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.69 130.13 55.67 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.2 1.0 . . . . 1.0 110.323 176.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.12 -177.2 51.85 Favored Glycine 0 N--CA 1.435 -1.427 0 CA-C-O 123.093 1.385 . . . . 1.0 114.096 178.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -64.96 -31.92 73.4 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 125.159 1.384 . . . . 1.0 113.042 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -91.32 7.12 42.48 Favored 'General case' 0 N--CA 1.432 -1.337 0 C-N-CA 125.851 1.66 . . . . 1.0 112.858 -173.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.65 7.38 87.49 Favored Glycine 0 N--CA 1.436 -1.329 0 O-C-N 120.805 -1.184 . . . . 1.0 115.125 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.4 m -85.31 133.39 34.15 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 121.342 -1.093 . . . . 1.0 110.075 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.4 p -139.86 130.78 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.108 0 C-N-CA 124.158 0.983 . . . . 1.0 112.611 -166.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.24 138.82 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.947 -1.72 . . . . 1.0 112.174 173.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.45 147.95 34.16 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-O 125.052 2.358 . . . . 1.0 115.488 175.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -132.95 140.62 47.91 Favored 'General case' 0 N--CA 1.432 -1.365 0 O-C-N 119.523 -1.985 . . . . 1.0 107.862 -170.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -104.56 118.96 37.88 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 126.318 1.847 . . . . 1.0 109.368 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.71 HG21 HD22 ' A' ' 20' ' ' LEU . 12.8 tt -148.46 154.81 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.317 0 CA-C-O 125.238 2.447 . . . . 1.0 111.537 -151.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -104.97 160.35 15.1 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 112.844 -1.98 . . . . 1.0 112.201 -176.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -61.74 -38.08 86.64 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 116.198 1.925 . . . . 1.0 116.198 -166.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -98.52 -9.8 24.45 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 119.982 -1.698 . . . . 1.0 113.654 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 88.9 m -62.05 121.68 67.29 Favored Pre-proline 0 N--CA 1.437 -1.101 0 C-N-CA 125.047 1.339 . . . . 1.0 111.402 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.59 160.23 44.53 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 CA-C-N 123.926 2.438 . . . . 1.0 114.309 -168.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.466 1.5 pp -61.45 -25.59 67.32 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 114.914 1.45 . . . . 1.0 114.914 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 99.0 p -52.77 -29.02 24.98 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.206 -1.559 . . . . 1.0 115.165 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.59 -46.98 67.91 Favored 'General case' 0 N--CA 1.437 -1.098 0 O-C-N 120.974 -1.079 . . . . 1.0 111.924 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.408 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -68.64 -31.5 70.69 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.667 -1.271 . . . . 1.0 112.914 174.605 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.6 ttp -59.82 -44.99 93.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.316 -1.49 . . . . 1.0 114.369 175.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -66.33 -38.44 87.68 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.778 -1.201 . . . . 1.0 112.697 174.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.96 -37.96 89.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 114.263 1.209 . . . . 1.0 114.263 174.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.01 -43.27 99.14 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 126.066 1.747 . . . . 1.0 111.902 174.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.3 m -62.17 -44.71 96.0 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.882 -1.136 . . . . 1.0 113.454 174.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -66.3 -49.52 66.78 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 114.17 1.174 . . . . 1.0 114.17 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -71.14 -43.29 67.87 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.04 -1.662 . . . . 1.0 115.285 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -115.32 6.35 14.88 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 121.077 -1.015 . . . . 1.0 112.929 -163.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.02 9.26 84.56 Favored Glycine 0 CA--C 1.493 -1.308 0 N-CA-C 117.153 1.621 . . . . 1.0 117.153 162.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.89 159.63 23.62 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.553 -1.557 . . . . 1.0 112.32 -175.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.3 m -102.33 134.02 46.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 O-C-N 121.1 -1.0 . . . . 1.0 110.146 172.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.7 ptp -66.26 -30.75 71.24 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 115.935 1.828 . . . . 1.0 115.935 -167.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt-85 -78.38 -15.04 59.1 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.348 -1.47 . . . . 1.0 113.455 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -92.07 -12.66 32.48 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.399 1.08 . . . . 1.0 111.756 -174.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -119.71 143.68 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.201 0 C-N-CA 124.34 1.056 . . . . 1.0 109.16 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -137.81 154.94 49.49 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.642 -1.286 . . . . 1.0 108.118 172.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -114.22 140.43 48.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 107.991 -1.115 . . . . 1.0 107.991 -162.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -129.67 149.54 51.38 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 120.822 -1.174 . . . . 1.0 109.191 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -123.53 112.31 17.32 Favored 'General case' 0 N--CA 1.433 -1.301 0 N-CA-C 107.81 -1.182 . . . . 1.0 107.81 160.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.6 t0 56.67 45.15 22.52 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 125.557 1.543 . . . . 1.0 113.974 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.94 1.44 84.88 Favored Glycine 0 N--CA 1.436 -1.309 0 N-CA-C 116.267 1.267 . . . . 1.0 116.267 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.61 125.81 31.87 Favored Pre-proline 0 N--CA 1.435 -1.223 0 CA-C-N 119.243 1.521 . . . . 1.0 108.994 -174.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -54.54 135.28 65.83 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.641 2.894 . . . . 1.0 115.79 169.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.8 pt -119.57 143.01 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -112.25 166.61 11.12 Favored 'General case' 0 CA--C 1.494 -1.2 0 O-C-N 120.407 -1.433 . . . . 1.0 110.995 -164.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -65.74 -21.49 66.52 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 119.825 -1.797 . . . . 1.0 114.755 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.1 m -82.89 -15.57 50.92 Favored 'General case' 0 N--CA 1.437 -1.109 0 C-N-CA 125.147 1.379 . . . . 1.0 112.959 171.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.8 168.75 19.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.217 -2.177 . . . . 1.0 112.637 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.1 p -148.63 158.81 39.65 Favored Pre-proline 0 CA--C 1.497 -1.08 0 O-C-N 120.179 -1.575 . . . . 1.0 110.68 -157.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -59.72 -30.91 93.25 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.18 2.586 . . . . 1.0 115.523 171.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.53 -46.03 74.01 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-O 122.035 0.921 . . . . 1.0 113.434 174.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -71.11 -42.56 69.13 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.717 1.207 . . . . 1.0 113.906 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.54 -8.54 58.88 Favored 'General case' 0 N--CA 1.435 -1.21 0 O-C-N 121.19 -0.944 . . . . 1.0 111.233 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 63.21 48.24 3.76 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 126.584 1.954 . . . . 1.0 112.983 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -64.67 148.55 50.77 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 127.201 2.201 . . . . 1.0 112.997 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -101.52 176.89 5.08 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 124.423 1.089 . . . . 1.0 110.069 -173.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.417 14.0 p-10 -60.48 -26.64 66.95 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 116.689 2.107 . . . . 1.0 116.689 -175.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -135.16 90.94 2.68 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.918 1.287 . . . . 1.0 108.442 157.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.51 163.57 22.59 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.845 -1.159 . . . . 1.0 114.013 -174.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.1 m -130.75 115.24 16.38 Favored 'General case' 0 CA--C 1.496 -1.098 0 O-C-N 121.307 -0.871 . . . . 1.0 110.337 177.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 47.1 mm -120.12 140.72 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 128.395 2.678 . . . . 1.0 109.452 -171.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -110.86 138.32 47.41 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 119.987 -1.696 . . . . 1.0 108.547 -164.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -115.56 133.53 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-O 122.789 1.28 . . . . 1.0 110.169 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -116.18 138.72 51.03 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 125.057 1.343 . . . . 1.0 110.218 169.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -89.11 137.21 32.53 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.884 -1.135 . . . . 1.0 111.874 -173.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -107.66 -155.94 0.57 Allowed 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.499 1.52 . . . . 1.0 110.5 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -62.94 111.19 2.04 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 125.609 1.563 . . . . 1.0 115.122 -176.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 81.2 p -94.58 -9.63 34.56 Favored 'General case' 0 CA--C 1.496 -1.117 0 O-C-N 120.08 -1.638 . . . . 1.0 112.313 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.8 -0.44 84.89 Favored Glycine 0 N--CA 1.436 -1.366 0 O-C-N 120.542 -1.349 . . . . 1.0 115.891 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.753 0 C-N-CA 124.736 1.16 . . . . 1.0 111.283 -178.417 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.869 0 CA-C-O 119.853 -0.415 . . . . 1.0 113.009 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.277 0.2 OUTLIER -74.81 -49.1 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.18 0 CA-C-N 120.032 1.916 . . . . 1.0 114.504 -176.214 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.2 mt -112.5 118.59 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 N-CA-C 108.39 -0.967 . . . . 1.0 108.39 -173.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -102.14 108.35 19.72 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 119.982 -1.698 . . . . 1.0 108.857 166.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.3 pp -107.95 156.32 19.34 Favored 'General case' 0 N--CA 1.437 -1.101 0 O-C-N 119.766 -1.834 . . . . 1.0 113.471 -170.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . 0.304 7.4 t -92.9 -145.12 0.22 Allowed 'General case' 0 N--CA 1.438 -1.036 0 C-N-CA 124.799 1.24 . . . . 1.0 112.175 178.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.256 23.8 ttt 80.32 103.78 0.07 Allowed 'General case' 0 N--CA 1.437 -1.088 0 C-N-CA 128.362 2.665 . . . . 1.0 115.504 175.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 49.42 -170.07 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.215 0 C-N-CA 130.004 3.321 . . . . 1.0 116.312 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 5.2 t0 75.29 159.73 0.22 Allowed 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 116.952 2.205 . . . . 1.0 116.952 146.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -80.74 115.33 20.18 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.882 -1.136 . . . . 1.0 113.044 -177.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.255 40.8 tt0 . . . . . 0 N--CA 1.426 -1.646 0 C-N-CA 125.51 1.524 . . . . 1.0 114.288 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.5 mmm . . . . . 0 N--CA 1.483 1.197 0 CA-C-O 118.87 -0.586 . . . . 1.0 111.886 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.81 -40.91 97.76 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 121.15 1.795 . . . . 1.0 115.454 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -88.77 144.36 26.29 Favored 'General case' 0 N--CA 1.435 -1.225 0 C-N-CA 123.838 0.855 . . . . 1.0 110.497 168.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -158.55 155.47 28.42 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.999 -1.063 . . . . 1.0 110.428 174.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -64.74 141.12 98.23 Favored Pre-proline 0 N--CA 1.435 -1.214 0 N-CA-C 115.25 1.574 . . . . 1.0 115.25 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -45.77 158.27 0.28 Allowed 'Trans proline' 0 N--CA 1.442 -1.521 1 C-N-CA 125.377 4.051 . . . . 1.0 118.991 164.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -116.5 9.9 14.4 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.426 1.09 . . . . 1.0 113.409 -164.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -60.21 142.65 54.14 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 115.778 1.77 . . . . 1.0 115.778 -174.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -71.77 133.16 20.72 Favored Glycine 0 N--CA 1.437 -1.266 0 O-C-N 120.753 -1.217 . . . . 1.0 115.174 175.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.1 m -121.95 -2.92 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.144 0 C-N-CA 124.513 1.125 . . . . 1.0 112.42 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -104.04 62.1 0.74 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.886 -1.759 . . . . 1.0 109.352 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 35.9 p -99.58 -10.57 21.89 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 125.216 1.406 . . . . 1.0 113.607 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 48.59 50.56 16.87 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 117.676 2.473 . . . . 1.0 117.676 166.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -101.07 -7.88 22.82 Favored 'General case' 0 N--CA 1.436 -1.149 0 O-C-N 119.625 -1.922 . . . . 1.0 115.01 -170.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -121.57 141.69 50.84 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.992 -1.068 . . . . 1.0 109.984 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . 0.276 40.8 m-20 -70.66 -40.61 72.92 Favored 'General case' 0 CA--C 1.49 -1.351 0 CA-C-O 124.839 2.257 . . . . 1.0 114.927 -178.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 -65.2 124.32 21.84 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 110.117 -3.22 . . . . 1.0 115.464 168.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.5 pt -143.02 160.83 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 C-N-CA 130.917 3.687 . . . . 1.0 105.991 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -113.74 144.81 42.34 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 118.21 -2.806 . . . . 1.0 107.55 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.786 HD22 HG21 ' A' ' 34' ' ' ILE . 1.0 OUTLIER -133.8 156.6 47.73 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 119.327 -2.108 . . . . 1.0 105.975 173.801 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.38 150.64 50.65 Favored 'General case' 0 N--CA 1.434 -1.26 0 O-C-N 119.809 -1.807 . . . . 1.0 112.524 171.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.1 t -113.02 129.15 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.921 -1.511 . . . . 1.0 106.921 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 136.37 54.88 Favored 'General case' 0 N--CA 1.433 -1.324 0 C-N-CA 124.504 1.122 . . . . 1.0 112.453 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 143.91 -143.37 12.15 Favored Glycine 0 CA--C 1.494 -1.277 0 O-C-N 121.06 -1.025 . . . . 1.0 114.719 170.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.8 tm0? 76.2 -65.72 0.3 Allowed 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 127.247 2.219 . . . . 1.0 114.752 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -153.57 22.86 0.53 Allowed 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 125.849 1.66 . . . . 1.0 108.555 -175.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.26 24.93 27.71 Favored Glycine 0 CA--C 1.493 -1.3 0 O-C-N 120.927 -1.108 . . . . 1.0 113.939 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.9 t -104.28 128.02 51.99 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 121.206 -1.173 . . . . 1.0 110.141 -175.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t -125.89 126.81 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 N-CA-C 107.421 -1.326 . . . . 1.0 107.421 175.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.541 ' CG2' HG11 ' B' ' 966' ' ' VAL . 1.1 p -129.16 138.02 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.101 0 O-C-N 121.325 -0.86 . . . . 1.0 111.204 174.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.41 ' HG3' HG23 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -100.98 160.07 14.68 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.829 3.204 . . . . 1.0 115.821 171.817 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -141.92 140.65 32.86 Favored 'General case' 0 N--CA 1.427 -1.61 0 O-C-N 118.954 -2.341 . . . . 1.0 105.174 -175.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.3 ttpt -101.39 117.32 34.7 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.336 -1.477 . . . . 1.0 107.618 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.786 HG21 HD22 ' A' ' 20' ' ' LEU . 6.4 tt -138.54 154.83 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-O 123.903 1.811 . . . . 1.0 110.09 -151.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -121.91 159.33 27.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.595 -1.639 . . . . 1.0 111.417 -177.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -71.23 -18.68 62.44 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 117.21 2.3 . . . . 1.0 117.21 -164.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 -81.75 -28.64 33.22 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.925 -1.734 . . . . 1.0 112.481 167.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.4 m -66.88 116.16 32.45 Favored Pre-proline 0 N--CA 1.437 -1.088 0 N-CA-C 114.654 1.353 . . . . 1.0 114.654 -166.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.42 161.78 44.51 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 123.477 2.785 . . . . 1.0 115.099 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.454 3.0 pp -64.9 -25.63 67.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 114.582 1.327 . . . . 1.0 114.582 -178.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.5 p -52.85 -29.26 27.01 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 115.326 1.602 . . . . 1.0 115.326 167.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.19 -46.82 54.69 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.246 -1.534 . . . . 1.0 111.785 -171.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.761 HD13 ' H ' ' A' ' 43' ' ' LEU 0.337 0.0 OUTLIER -70.18 -31.29 68.69 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 113.995 1.109 . . . . 1.0 113.995 174.21 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.7 ttm -59.74 -45.85 90.95 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.413 -1.429 . . . . 1.0 113.797 170.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -65.15 -38.22 89.91 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.426 -1.421 . . . . 1.0 113.669 171.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.82 82.03 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 119.994 -1.691 . . . . 1.0 114.219 176.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.59 -41.13 94.08 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.695 1.998 . . . . 1.0 110.677 171.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 67.3 m -64.11 -43.51 95.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 120.66 -1.275 . . . . 1.0 113.812 172.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.93 -51.0 62.43 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.384 -1.448 . . . . 1.0 114.295 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -72.63 -43.21 63.53 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.365 -1.459 . . . . 1.0 114.77 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -116.26 12.26 15.34 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 121.799 0.809 . . . . 1.0 112.185 -162.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.38 10.8 85.59 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.411 1.325 . . . . 1.0 116.411 160.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.0 mt -80.48 159.95 25.41 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 124.887 1.275 . . . . 1.0 113.321 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 74.6 m -102.27 130.6 49.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.977 -1.077 . . . . 1.0 110.812 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.7 tpt -59.89 -38.27 81.76 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 116.298 1.962 . . . . 1.0 116.298 -165.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.422 ' NH1' HE22 ' A' ' 57' ' ' GLN . 7.7 ptm180 -94.71 1.68 55.51 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 120.705 -1.247 . . . . 1.0 111.993 -176.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.422 HE22 ' NH1' ' A' ' 56' ' ' ARG . 11.6 mp0 -102.17 -8.37 21.4 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 121.086 -1.008 . . . . 1.0 111.126 175.34 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 pt -116.83 138.12 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.215 0 O-C-N 120.483 -1.386 . . . . 1.0 109.34 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -138.18 154.96 49.12 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 106.675 -1.602 . . . . 1.0 106.675 173.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -115.88 148.74 39.65 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.994 1.378 . . . . 1.0 111.077 -169.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.8 ptt180 -136.31 150.16 48.76 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 121.083 -1.011 . . . . 1.0 109.57 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -124.74 109.05 12.63 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.166 -1.79 . . . . 1.0 106.166 173.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . 0.435 38.3 m-20 59.67 -127.04 1.18 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-O 116.721 -1.609 . . . . 1.0 110.826 -144.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.25 -16.2 53.35 Favored Glycine 0 CA--C 1.495 -1.158 3 C-N-CA 138.983 7.944 . . . . 1.0 118.565 7.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -123.6 129.47 24.84 Favored Pre-proline 0 N--CA 1.435 -1.19 0 CA-C-N 120.11 1.955 . . . . 1.0 109.142 160.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.26 135.19 66.56 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.703 2.269 . . . . 1.0 113.048 156.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.6 pt -117.64 138.68 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.16 0 CA-C-O 122.142 0.972 . . . . 1.0 108.481 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -112.72 165.99 11.77 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 121.188 -0.945 . . . . 1.0 109.841 -162.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -71.7 -13.83 61.85 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.745 -1.847 . . . . 1.0 113.719 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.5 m -90.23 -7.42 53.56 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 126.295 1.838 . . . . 1.0 111.728 169.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -82.38 165.07 20.61 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 118.387 -2.695 . . . . 1.0 110.661 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.7 p -151.22 164.38 20.44 Favored Pre-proline 0 CA--C 1.498 -1.022 0 O-C-N 120.523 -1.361 . . . . 1.0 110.656 -154.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -60.3 -36.0 89.35 Favored 'Trans proline' 0 N--CA 1.441 -1.599 0 C-N-CA 123.044 2.496 . . . . 1.0 113.999 171.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.18 80.58 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-O 122.57 1.176 . . . . 1.0 112.574 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -68.77 -45.18 72.04 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.453 1.101 . . . . 1.0 113.376 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.8 tp -89.48 -8.4 52.96 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 121.061 -1.024 . . . . 1.0 112.781 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.26 33.0 mt-10 64.35 44.06 4.42 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 127.802 2.441 . . . . 1.0 115.663 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.7 mtt -57.11 154.24 10.31 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 129.17 2.988 . . . . 1.0 113.771 173.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.439 ' HG3' ' H ' ' A' ' 80' ' ' ASP . 13.4 tp10 -142.19 -176.23 4.74 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 106.793 -1.558 . . . . 1.0 106.793 -172.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.439 ' H ' ' HG3' ' A' ' 79' ' ' GLU 0.312 0.9 OUTLIER -53.16 -26.54 17.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.084 2.954 . . . . 1.0 118.628 -165.968 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -140.36 56.36 1.6 Allowed 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 124.784 1.234 . . . . 1.0 110.528 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.45 162.31 25.81 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 119.608 -1.933 . . . . 1.0 116.057 -174.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.2 m -131.72 118.98 20.7 Favored 'General case' 0 CA--C 1.497 -1.088 0 O-C-N 120.968 -1.082 . . . . 1.0 111.795 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.3 mt -119.27 140.7 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 C-N-CA 126.495 1.918 . . . . 1.0 108.995 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.95 137.38 48.65 Favored 'General case' 0 N--CA 1.434 -1.253 0 O-C-N 120.289 -1.507 . . . . 1.0 108.026 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.1 p -108.58 136.75 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.146 0 O-C-N 120.509 -1.369 . . . . 1.0 109.946 -177.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -122.44 143.55 49.61 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.647 -1.283 . . . . 1.0 108.374 171.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -86.96 135.1 33.41 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.129 0.966 . . . . 1.0 112.15 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 -129.75 168.93 15.78 Favored 'General case' 0 N--CA 1.432 -1.333 0 C-N-CA 125.397 1.479 . . . . 1.0 109.675 -178.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 49.99 47.43 23.32 Favored 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 117.63 2.455 . . . . 1.0 117.63 169.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.1 m -83.94 124.02 30.57 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.359 -1.463 . . . . 1.0 109.708 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 82.18 12.86 80.18 Favored Glycine 0 N--CA 1.437 -1.269 0 O-C-N 120.405 -1.434 . . . . 1.0 114.982 -177.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.801 0 CA-C-N 118.042 0.921 . . . . 1.0 111.477 178.223 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.001 0 N-CA-C 114.181 0.433 . . . . 1.0 114.181 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 966' ' ' VAL . . . . . 0.541 HG11 ' CG2' ' A' ' 30' ' ' VAL . 9.5 t -90.78 -110.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 120.808 -1.407 . . . . 1.0 112.468 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 967' ' ' ILE . . . . . 0.403 ' H ' ' HB ' ' B' ' 966' ' ' VAL . 0.9 OUTLIER -86.51 130.39 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 O-C-N 120.433 -1.417 . . . . 1.0 110.437 -155.263 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -102.17 112.34 24.97 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.918 -1.739 . . . . 1.0 109.981 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 56.2 mt -83.18 140.65 32.45 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 119.011 -2.306 . . . . 1.0 116.108 -174.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 77.2 p -95.07 -126.86 0.12 Allowed 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 124.906 1.282 . . . . 1.0 109.715 167.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 21.8 ttt 78.76 -40.29 0.26 Allowed 'General case' 0 N--CA 1.437 -1.095 0 C-N-CA 127.835 2.454 . . . . 1.0 115.508 171.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -154.21 177.13 11.45 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.767 1.627 . . . . 1.0 106.693 173.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -142.63 32.5 1.45 Allowed 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 120.361 -1.462 . . . . 1.0 113.993 -176.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -81.26 91.42 6.2 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.829 -1.17 . . . . 1.0 108.671 167.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 . . . . . 0 C--O 1.262 1.747 0 C-N-CA 127.798 2.439 . . . . 1.0 115.738 -172.098 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.2 mmm . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 110.682 -0.118 . . . . 1.0 110.682 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.4 -11.81 45.06 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.71 -1.868 . . . . 1.0 111.756 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -66.68 -25.43 66.55 Favored 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 126.892 2.077 . . . . 1.0 114.954 -178.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -95.83 1.91 53.43 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 124.845 1.258 . . . . 1.0 113.057 -176.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -74.09 150.8 88.03 Favored Pre-proline 0 N--CA 1.435 -1.217 0 C-N-CA 125.104 1.362 . . . . 1.0 111.763 170.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.22 140.7 31.21 Favored 'Trans proline' 0 N--CA 1.44 -1.627 0 C-N-CA 122.314 2.009 . . . . 1.0 112.655 178.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -72.56 149.34 44.11 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 122.717 1.246 . . . . 1.0 113.642 174.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.413 ' CD ' ' HD1' ' A' ' 17' ' ' HIS . 17.7 mt-10 -61.52 -40.41 94.52 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 125.516 1.526 . . . . 1.0 113.382 -178.015 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -49.87 -51.71 28.25 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 125.114 1.34 . . . . 1.0 116.391 168.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.7 t -69.34 -47.15 74.86 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.111 0 O-C-N 121.043 -1.269 . . . . 1.0 112.837 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -65.45 -35.6 81.4 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 126.192 1.797 . . . . 1.0 114.002 -176.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.258 11.3 m 69.03 45.57 0.9 Allowed 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.542 2.337 . . . . 1.0 111.563 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -154.41 152.42 30.15 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.614 -1.304 . . . . 1.0 107.691 177.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -90.22 135.07 33.89 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 121.016 -1.053 . . . . 1.0 111.707 -171.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -127.43 -75.85 0.57 Allowed 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.998 -1.064 . . . . 1.0 109.592 -179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -101.87 -0.3 34.29 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 122.437 1.113 . . . . 1.0 112.993 -168.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.413 ' HD1' ' CD ' ' A' ' 8' ' ' GLU . 68.1 m80 -89.66 144.98 25.56 Favored 'General case' 0 N--CA 1.433 -1.298 0 C-N-CA 127.907 2.483 . . . . 1.0 110.844 162.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.3 pt -143.02 160.84 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 130.488 3.515 . . . . 1.0 104.961 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -109.58 144.79 37.4 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 119.102 -2.249 . . . . 1.0 108.431 166.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.82 HD22 HG21 ' A' ' 34' ' ' ILE . 1.1 pt? -128.2 154.29 45.98 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.425 -2.047 . . . . 1.0 105.792 170.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 0.0 OUTLIER -124.07 150.68 44.7 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.701 -1.874 . . . . 1.0 111.756 169.803 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -110.9 136.78 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 O-C-N 121.166 -0.959 . . . . 1.0 108.64 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.17 130.15 53.58 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 124.494 1.118 . . . . 1.0 111.945 -174.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.71 -179.53 20.42 Favored Glycine 0 N--CA 1.435 -1.381 0 CA-C-O 122.915 1.286 . . . . 1.0 113.999 -177.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -99.15 3.66 46.61 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 125.238 1.415 . . . . 1.0 111.868 -169.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -98.95 2.1 46.14 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 125.903 1.681 . . . . 1.0 110.112 167.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.7 9.09 85.12 Favored Glycine 0 N--CA 1.435 -1.38 0 O-C-N 120.553 -1.342 . . . . 1.0 113.429 -173.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.4 p -70.15 145.22 51.68 Favored 'General case' 0 CA--C 1.494 -1.181 0 O-C-N 120.572 -1.546 . . . . 1.0 112.031 175.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p -139.79 127.05 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.239 0 N-CA-C 109.077 -0.712 . . . . 1.0 109.077 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.423 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.311 0.3 OUTLIER -129.36 135.86 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.105 0 O-C-N 119.692 -1.88 . . . . 1.0 111.164 166.15 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.417 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -110.13 153.98 23.94 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 124.794 2.235 . . . . 1.0 114.377 175.64 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.5 140.53 37.24 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 106.477 -1.675 . . . . 1.0 106.477 -170.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -99.54 118.08 35.33 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.191 1.796 . . . . 1.0 107.084 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.82 HG21 HD22 ' A' ' 20' ' ' LEU . 8.7 tt -143.84 154.72 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.423 0 C-N-CA 126.595 1.958 . . . . 1.0 109.556 -154.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -116.55 161.16 19.57 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 113.172 -1.831 . . . . 1.0 112.399 -173.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -61.41 -38.02 85.59 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 125.329 1.452 . . . . 1.0 114.707 -164.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -101.08 14.5 31.76 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 124.373 1.069 . . . . 1.0 113.515 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.2 m -86.45 121.48 72.3 Favored Pre-proline 0 CA--C 1.497 -1.065 0 CA-C-O 116.703 -1.618 . . . . 1.0 109.367 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.31 158.95 41.99 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 CA-C-N 125.653 3.055 . . . . 1.0 115.534 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.403 1.3 pp -63.63 -25.57 68.28 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 125.302 1.441 . . . . 1.0 114.404 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -52.72 -29.11 25.05 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.501 -1.374 . . . . 1.0 114.222 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -42.69 68.86 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.442 -1.411 . . . . 1.0 111.524 -176.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.67 -37.14 84.17 Favored 'General case' 0 N--CA 1.434 -1.239 0 O-C-N 120.467 -1.396 . . . . 1.0 113.283 171.12 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.8 ttm -61.94 -42.63 99.33 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 119.83 -1.794 . . . . 1.0 113.872 175.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -43.57 98.45 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.746 1.26 . . . . 1.0 112.326 175.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.13 89.94 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 125.506 1.522 . . . . 1.0 113.837 177.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -61.03 -42.38 98.36 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 125.626 1.57 . . . . 1.0 111.561 172.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.2 m -63.57 -43.17 97.8 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.915 -1.116 . . . . 1.0 113.528 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.56 -48.78 63.37 Favored 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 124.36 1.064 . . . . 1.0 113.394 177.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -73.6 -43.02 60.76 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 116.537 2.051 . . . . 1.0 116.537 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -112.9 10.15 18.96 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.957 -1.089 . . . . 1.0 111.883 -165.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.0 43.17 10.05 Favored Glycine 0 CA--C 1.494 -1.246 0 N-CA-C 117.869 1.908 . . . . 1.0 117.869 160.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.5 mt -123.3 161.93 23.67 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 121.1 -1.235 . . . . 1.0 110.556 -168.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.8 m -102.23 133.21 47.48 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 120.137 -1.602 . . . . 1.0 111.084 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.5 tpt -58.68 -39.33 80.38 Favored 'General case' 0 N--CA 1.437 -1.112 0 N-CA-C 116.662 2.097 . . . . 1.0 116.662 -167.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -92.57 1.47 57.24 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.565 -1.334 . . . . 1.0 112.588 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -100.14 -21.82 15.41 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 124.486 1.114 . . . . 1.0 112.601 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.8 pt -112.95 149.66 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 124.252 1.021 . . . . 1.0 108.947 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.23 154.99 49.07 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.837 -1.164 . . . . 1.0 109.102 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -115.08 147.28 40.38 Favored 'General case' 0 N--CA 1.434 -1.243 0 O-C-N 120.934 -1.104 . . . . 1.0 110.613 -173.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 58.9 mtm180 -130.94 161.06 32.73 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 121.212 -0.93 . . . . 1.0 110.95 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -131.91 114.52 14.75 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.083 0.468 . . . . 1.0 109.99 164.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 t0 53.79 42.36 31.79 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 127.311 2.244 . . . . 1.0 114.066 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.95 0.78 83.27 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 124.978 1.275 . . . . 1.0 115.761 -176.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -99.9 137.6 20.18 Favored Pre-proline 0 N--CA 1.434 -1.242 0 O-C-N 120.337 -1.684 . . . . 1.0 109.53 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.97 137.66 24.57 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 CA-C-N 122.873 2.062 . . . . 1.0 112.127 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 19.4 pt -118.42 140.52 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.14 0 N-CA-C 106.011 -1.848 . . . . 1.0 106.011 177.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -106.64 161.52 14.57 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.163 -1.585 . . . . 1.0 109.711 -166.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -57.79 -34.97 70.19 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.403 -2.06 . . . . 1.0 115.532 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -78.55 -12.64 60.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.282 1.033 . . . . 1.0 113.145 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -74.04 170.52 15.27 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 119.475 -2.015 . . . . 1.0 111.66 177.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 63.9 p -148.02 162.31 31.51 Favored Pre-proline 0 CA--C 1.499 -0.992 0 O-C-N 119.065 -2.272 . . . . 1.0 112.746 -153.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_exo -55.04 -36.52 92.95 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 124.389 3.393 . . . . 1.0 115.857 163.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.55 -45.6 89.77 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 119.556 1.071 . . . . 1.0 113.639 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.61 -44.97 76.78 Favored 'General case' 0 N--CA 1.432 -1.345 0 C-N-CA 124.706 1.202 . . . . 1.0 112.624 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -90.6 -8.5 49.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 120.527 -1.358 . . . . 1.0 113.15 -176.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 69.48 37.79 1.91 Allowed 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 128.573 2.749 . . . . 1.0 114.675 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 52.5 mtt -58.19 152.76 16.4 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 128.326 2.65 . . . . 1.0 115.593 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.3 178.32 5.42 Favored 'General case' 0 N--CA 1.433 -1.307 0 O-C-N 121.139 -0.976 . . . . 1.0 109.666 -167.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.346 14.3 p-10 -54.38 -26.56 30.92 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 117.246 2.313 . . . . 1.0 117.246 -174.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -136.66 62.03 1.62 Allowed 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.52 1.528 . . . . 1.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.63 166.45 20.71 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 119.203 -2.186 . . . . 1.0 115.21 -177.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.7 m -133.56 121.56 22.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 O-C-N 121.04 -1.037 . . . . 1.0 110.7 -174.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.2 mm -118.67 140.71 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.103 0 C-N-CA 126.954 2.102 . . . . 1.0 109.327 -175.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -110.97 141.73 44.04 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.993 -1.692 . . . . 1.0 109.256 -167.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.1 t -108.49 128.97 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.181 0 CA-C-O 122.41 1.1 . . . . 1.0 109.842 -176.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -116.45 139.67 50.2 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 122.742 1.258 . . . . 1.0 111.159 173.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -96.84 120.32 36.96 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 121.254 -0.904 . . . . 1.0 111.81 -167.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -97.9 -26.72 14.57 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.831 -1.168 . . . . 1.0 110.596 174.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -60.26 146.9 42.13 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.944 1.298 . . . . 1.0 113.52 160.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 t -153.95 160.12 41.96 Favored 'General case' 0 CA--C 1.495 -1.154 0 N-CA-C 107.142 -1.429 . . . . 1.0 107.142 177.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -55.03 170.37 1.54 Allowed Glycine 0 N--CA 1.437 -1.266 0 N-CA-C 118.098 1.999 . . . . 1.0 118.098 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.679 0 O-C-N 120.602 -1.528 . . . . 1.0 110.394 -177.602 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 CA-C-O 119.846 -0.419 . . . . 1.0 112.787 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 966' ' ' VAL . . . . . 0.423 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.27 0.2 OUTLIER -74.91 -51.49 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.114 0 CA-C-N 119.772 1.786 . . . . 1.0 114.601 -175.79 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -108.68 116.57 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 N-CA-C 107.418 -1.327 . . . . 1.0 107.418 -172.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -102.21 110.66 22.68 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.918 -1.739 . . . . 1.0 106.671 167.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.445 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.5 pp -108.03 143.33 36.88 Favored 'General case' 0 CA--C 1.498 -1.057 0 O-C-N 120.048 -1.657 . . . . 1.0 113.621 -170.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 45.5 p -94.09 -106.96 0.13 Allowed 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 125.956 1.702 . . . . 1.0 112.148 -170.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 13.1 ttt 79.12 -60.99 0.35 Allowed 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 128.448 2.699 . . . . 1.0 115.9 174.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -161.67 166.49 26.66 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 103.443 -2.799 . . . . 1.0 103.443 176.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 63.13 39.9 9.48 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 127.014 2.126 . . . . 1.0 112.196 -170.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 43.53 -139.83 0.23 Allowed 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 114.415 1.265 . . . . 1.0 114.415 -165.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.277 24.4 tt0 . . . . . 0 C--O 1.26 1.614 0 O-C-N 119.939 -1.726 . . . . 1.0 115.579 170.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 ttt . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 112.29 0.478 . . . . 1.0 112.29 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.04 -44.85 79.17 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 129.039 2.936 . . . . 1.0 112.51 -12.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 55.69 42.06 29.76 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 126.283 1.833 . . . . 1.0 113.156 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.99 131.57 48.03 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 125.415 1.486 . . . . 1.0 114.541 -168.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -89.35 137.24 29.21 Favored Pre-proline 0 N--CA 1.432 -1.331 0 C-N-CA 125.038 1.335 . . . . 1.0 109.976 176.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -100.38 60.21 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.555 0 CA-C-N 124.056 2.484 . . . . 1.0 109.864 -161.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 56.65 50.27 13.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 126.29 1.836 . . . . 1.0 114.692 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -67.74 149.29 50.15 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 126.61 1.964 . . . . 1.0 113.94 177.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.56 -5.44 89.3 Favored Glycine 0 N--CA 1.437 -1.27 0 N-CA-C 116.834 1.494 . . . . 1.0 116.834 -174.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.9 m -60.07 143.46 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 N-CA-C 115.243 1.572 . . . . 1.0 115.243 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.6 mttt 59.45 31.04 20.77 Favored 'General case' 0 CA--C 1.496 -1.101 0 C-N-CA 127.354 2.262 . . . . 1.0 114.215 177.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.5 m 62.76 37.61 12.39 Favored 'General case' 0 N--CA 1.437 -1.087 0 C-N-CA 127.752 2.421 . . . . 1.0 111.038 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 60.62 45.58 10.25 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.475 1.91 . . . . 1.0 114.614 -176.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -138.5 171.32 14.53 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 125.401 1.48 . . . . 1.0 107.341 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -140.09 176.77 8.48 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.553 -1.342 . . . . 1.0 110.18 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -86.89 23.28 1.77 Allowed 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 115.302 1.593 . . . . 1.0 115.302 -161.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -76.59 133.11 39.75 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.337 -1.477 . . . . 1.0 114.526 174.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.2 pt -142.95 160.82 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.299 1 C-N-CA 131.893 4.077 . . . . 1.0 106.096 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -113.89 144.93 42.22 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 117.722 -3.111 . . . . 1.0 110.112 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 HG21 ' A' ' 34' ' ' ILE . 1.0 OUTLIER -129.95 148.51 51.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 119.036 -2.29 . . . . 1.0 107.689 171.207 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 8.6 ptpt -115.03 150.63 35.58 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 119.478 -2.014 . . . . 1.0 111.63 169.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.8 p -119.59 131.57 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 O-C-N 121.062 -1.023 . . . . 1.0 108.822 175.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.62 130.25 51.26 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 122.791 1.281 . . . . 1.0 112.654 -175.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -87.06 -176.3 49.11 Favored Glycine 0 N--CA 1.435 -1.429 0 CA-C-O 123.328 1.516 . . . . 1.0 115.572 -177.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -82.7 -10.92 58.7 Favored 'General case' 0 N--CA 1.435 -1.224 0 O-C-N 120.864 -1.374 . . . . 1.0 113.599 -173.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -99.36 2.16 45.03 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 121.244 -0.91 . . . . 1.0 110.868 167.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 86.7 5.57 81.36 Favored Glycine 0 CA--C 1.493 -1.284 0 O-C-N 119.929 -1.732 . . . . 1.0 115.633 177.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.1 m -70.23 139.46 52.24 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 121.035 -1.274 . . . . 1.0 111.35 172.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.3 p -139.74 136.18 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-O 121.71 0.767 . . . . 1.0 112.031 -166.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -129.21 138.74 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 O-C-N 119.722 -1.861 . . . . 1.0 110.842 167.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -113.68 146.4 39.87 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-O 124.688 2.185 . . . . 1.0 114.138 176.103 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.54 140.62 49.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.827 -1.796 . . . . 1.0 107.591 -170.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -100.34 116.54 32.55 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 125.231 1.412 . . . . 1.0 109.491 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.693 HG21 HD22 ' A' ' 20' ' ' LEU . 11.3 tt -141.73 154.85 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.39 0 C-N-CA 128.167 2.587 . . . . 1.0 110.11 -152.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.55 164.28 14.54 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 112.974 -1.921 . . . . 1.0 112.448 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -67.28 -38.07 84.47 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 115.081 1.512 . . . . 1.0 115.081 -165.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -98.11 31.09 2.84 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 124.861 1.264 . . . . 1.0 112.08 174.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.4 m -114.65 111.68 45.99 Favored Pre-proline 0 N--CA 1.436 -1.153 0 O-C-N 120.585 -1.322 . . . . 1.0 107.596 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -62.04 160.17 31.18 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 123.98 3.12 . . . . 1.0 116.432 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.378 2.0 pp -63.89 -25.65 68.25 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 122.941 1.353 . . . . 1.0 114.15 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 t -52.51 -29.21 23.95 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 125.289 1.435 . . . . 1.0 113.896 169.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -66.75 -44.04 82.52 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.124 -1.61 . . . . 1.0 112.876 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.08 -32.2 70.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.493 -1.379 . . . . 1.0 113.101 174.052 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.0 ttm -60.59 -44.43 96.26 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 120.277 -1.514 . . . . 1.0 114.175 173.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -66.15 -38.25 87.67 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.566 -1.333 . . . . 1.0 113.339 172.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.93 85.31 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 120.179 -1.575 . . . . 1.0 114.048 175.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -62.55 -41.6 99.0 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 125.846 1.658 . . . . 1.0 112.257 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.5 -44.02 97.4 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 125.467 1.507 . . . . 1.0 113.014 171.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -64.9 -50.01 68.21 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.32 -1.487 . . . . 1.0 114.101 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -77.04 -43.34 34.92 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 115.345 1.609 . . . . 1.0 115.345 -177.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -113.44 -0.45 14.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.899 -1.125 . . . . 1.0 112.013 -165.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 2.69 89.15 Favored Glycine 0 CA--C 1.493 -1.283 0 N-CA-C 117.713 1.845 . . . . 1.0 117.713 164.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.45 153.21 37.74 Favored 'General case' 0 N--CA 1.433 -1.31 0 O-C-N 120.856 -1.379 . . . . 1.0 111.993 -170.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.2 m -99.32 127.73 45.37 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 120.724 -1.235 . . . . 1.0 109.442 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.6 ptp -66.53 -20.79 66.11 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.036 -1.665 . . . . 1.0 115.133 -174.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptt85 -75.75 -11.07 59.92 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 124.57 1.148 . . . . 1.0 114.019 170.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -109.38 -8.37 15.07 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.336 -1.477 . . . . 1.0 113.594 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.1 pt -128.49 150.19 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.16 0 O-C-N 120.128 -1.607 . . . . 1.0 109.99 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.24 150.0 46.29 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 107.959 -1.126 . . . . 1.0 107.959 170.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -108.38 144.58 35.76 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 121.206 -0.934 . . . . 1.0 109.676 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -134.13 159.1 41.9 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 122.48 1.133 . . . . 1.0 111.24 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -139.1 123.55 18.29 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 108.048 -1.094 . . . . 1.0 108.048 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 56.27 38.39 29.74 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 126.211 1.804 . . . . 1.0 113.351 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.28 2.73 84.42 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 116.287 1.275 . . . . 1.0 116.287 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -116.13 140.62 26.6 Favored Pre-proline 0 N--CA 1.435 -1.196 0 CA-C-N 120.094 1.947 . . . . 1.0 109.642 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -48.82 135.3 28.5 Favored 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 124.155 3.237 . . . . 1.0 117.245 169.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 pt -117.93 138.19 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.242 0 N-CA-C 106.329 -1.73 . . . . 1.0 106.329 169.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -104.12 167.14 9.95 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 121.096 -1.003 . . . . 1.0 109.887 -162.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -78.14 -16.54 57.85 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.032 -2.293 . . . . 1.0 111.259 -176.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.21 -13.83 59.45 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 130.959 3.703 . . . . 1.0 113.607 167.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -86.08 169.61 12.99 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 119.639 -1.913 . . . . 1.0 111.361 171.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.2 p -151.51 161.15 30.47 Favored Pre-proline 0 CA--C 1.496 -1.1 0 O-C-N 120.201 -1.562 . . . . 1.0 110.612 -158.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -58.42 -31.56 94.34 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 C-N-CA 123.846 3.031 . . . . 1.0 115.32 167.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.44 -46.07 74.2 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 119.544 1.065 . . . . 1.0 113.033 172.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -69.31 -37.73 77.91 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 124.499 1.12 . . . . 1.0 113.755 -176.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -95.18 -0.63 53.03 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 120.807 -1.183 . . . . 1.0 111.86 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 56.15 42.61 28.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 127.541 2.336 . . . . 1.0 115.86 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.8 mtt -59.84 149.42 31.41 Favored 'General case' 0 N--CA 1.434 -1.275 0 C-N-CA 127.126 2.17 . . . . 1.0 113.748 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -109.67 -172.38 2.03 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 121.358 -0.839 . . . . 1.0 109.113 -165.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.363 14.0 p-10 -60.21 -26.47 66.42 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.045 -1.659 . . . . 1.0 115.119 176.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -143.61 87.51 1.94 Allowed 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 124.416 1.087 . . . . 1.0 110.426 170.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.44 169.29 11.19 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 114.794 1.405 . . . . 1.0 114.794 178.273 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.3 m -136.45 123.13 21.06 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 124.874 1.269 . . . . 1.0 109.822 -175.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.8 mm -121.47 140.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 126.297 1.839 . . . . 1.0 108.883 -175.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -110.91 141.76 43.9 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.049 -1.657 . . . . 1.0 108.891 -171.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -108.59 139.63 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.142 0 O-C-N 120.522 -1.361 . . . . 1.0 109.542 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -124.45 137.46 54.44 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 122.206 1.003 . . . . 1.0 108.959 167.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -81.88 133.3 35.31 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.355 1.062 . . . . 1.0 112.228 -174.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -131.37 173.5 11.01 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 124.972 1.309 . . . . 1.0 111.029 -174.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -148.94 -14.16 0.31 Allowed 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 115.431 1.641 . . . . 1.0 115.431 -176.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 75.9 p -100.23 7.15 44.66 Favored 'General case' 0 CA--C 1.497 -1.077 0 O-C-N 119.508 -1.995 . . . . 1.0 114.492 -175.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -81.36 -4.68 90.39 Favored Glycine 0 CA--C 1.494 -1.263 0 N-CA-C 116.877 1.511 . . . . 1.0 116.877 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.683 0 O-C-N 120.806 -1.408 . . . . 1.0 110.916 -179.692 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.914 0 N-CA-C 114.076 0.39 . . . . 1.0 114.076 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.272 0.2 OUTLIER -74.86 -48.25 34.02 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.137 0 O-C-N 120.235 -1.744 . . . . 1.0 115.145 -172.439 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.1 mt -110.53 123.88 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 C-N-CA 124.218 1.007 . . . . 1.0 108.97 -170.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -102.14 105.63 16.36 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.52 -1.362 . . . . 1.0 108.294 165.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.9 pp -108.04 161.34 15.04 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.624 -1.297 . . . . 1.0 113.022 -178.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 12.0 t -122.68 -177.48 3.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.063 1.345 . . . . 1.0 109.805 178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.322 40.6 ttp 116.52 92.3 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.103 0 C-N-CA 130.069 3.348 . . . . 1.0 115.472 168.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 41.6 p-10 -173.68 -54.7 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 126.58 1.952 . . . . 1.0 110.586 169.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -152.95 20.51 0.59 Allowed 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 127.076 2.151 . . . . 1.0 108.661 -174.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . 0.268 11.1 tp10 67.96 -81.21 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.258 0 C-N-CA 128.477 2.711 . . . . 1.0 112.434 -161.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.259 29.8 tt0 . . . . . 0 C--O 1.262 1.727 0 C-N-CA 125.629 1.572 . . . . 1.0 114.91 172.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 120.447 0.165 . . . . 1.0 110.59 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.8 -35.21 74.64 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 120.049 -1.657 . . . . 1.0 114.968 176.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -61.56 146.26 49.38 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 115.042 1.497 . . . . 1.0 115.042 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -124.42 132.82 53.51 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.912 -1.117 . . . . 1.0 111.638 179.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.91 153.02 94.95 Favored Pre-proline 0 N--CA 1.436 -1.145 0 N-CA-C 116.58 2.067 . . . . 1.0 116.58 -175.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -46.16 142.8 8.26 Favored 'Trans proline' 0 N--CA 1.442 -1.516 0 C-N-CA 124.819 3.679 . . . . 1.0 118.64 161.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -84.15 149.29 26.27 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 124.447 1.099 . . . . 1.0 113.52 178.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -157.55 175.23 14.22 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.716 -1.24 . . . . 1.0 111.971 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 78.38 171.56 38.94 Favored Glycine 0 N--CA 1.436 -1.327 0 O-C-N 120.456 -1.403 . . . . 1.0 114.776 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.257 2.9 t 51.96 58.14 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.101 0 C-N-CA 126.82 2.048 . . . . 1.0 114.139 -178.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -88.0 63.16 7.2 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 119.377 -2.077 . . . . 1.0 112.675 -171.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 52.3 p -101.72 6.33 41.77 Favored 'General case' 0 CA--C 1.497 -1.068 0 C-N-CA 127.131 2.173 . . . . 1.0 112.88 -172.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.27 -40.18 93.15 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 127.443 2.297 . . . . 1.0 115.78 -170.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -137.15 -21.56 1.2 Allowed 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 124.039 0.935 . . . . 1.0 111.676 -175.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -124.45 123.36 39.98 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.603 1.161 . . . . 1.0 108.541 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -156.94 163.97 38.55 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 107.178 -1.415 . . . . 1.0 107.178 -178.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.5 135.42 45.67 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 116.295 1.961 . . . . 1.0 116.295 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.4 pt -138.06 160.78 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 129.132 2.973 . . . . 1.0 105.316 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -111.75 144.9 40.27 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.252 -2.155 . . . . 1.0 108.832 177.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.613 HD22 HG21 ' A' ' 34' ' ' ILE . 1.3 pt? -129.43 156.13 44.59 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 119.474 -2.016 . . . . 1.0 106.331 170.053 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.58 150.58 45.77 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 119.433 -2.042 . . . . 1.0 111.453 166.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 p -118.27 137.95 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 N-CA-C 108.377 -0.972 . . . . 1.0 108.377 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.88 130.2 49.71 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 121.356 -0.84 . . . . 1.0 112.498 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.98 168.02 30.03 Favored Glycine 0 N--CA 1.436 -1.364 0 CA-C-O 122.333 0.963 . . . . 1.0 114.587 -178.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 51.41 29.43 5.23 Favored 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 128.678 2.791 . . . . 1.0 117.058 175.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 61.65 26.15 15.89 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 126.445 1.898 . . . . 1.0 113.732 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.21 -16.68 0.02 OUTLIER Glycine 0 N--CA 1.435 -1.38 0 O-C-N 120.208 -1.558 . . . . 1.0 116.578 -177.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.1 t -90.45 128.12 36.42 Favored 'General case' 0 CA--C 1.494 -1.193 0 O-C-N 120.262 -1.728 . . . . 1.0 109.197 176.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.0 p -138.56 126.78 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 121.89 0.852 . . . . 1.0 108.853 163.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.292 0.3 OUTLIER -129.42 138.75 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 O-C-N 120.4 -1.437 . . . . 1.0 111.717 173.791 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.06 149.91 39.52 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 124.058 1.885 . . . . 1.0 115.022 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.49 140.58 31.91 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.534 -1.354 . . . . 1.0 108.974 -162.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -104.22 115.84 31.12 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 125.283 1.433 . . . . 1.0 113.172 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.613 HG21 HD22 ' A' ' 20' ' ' LEU . 13.5 tt -141.32 154.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-O 124.614 2.15 . . . . 1.0 111.576 -154.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -93.7 153.98 18.05 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 112.272 -2.24 . . . . 1.0 113.504 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 68.9 mtt-85 -69.8 -38.17 76.55 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 115.783 1.772 . . . . 1.0 115.783 -172.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 30.3 t-80 -101.43 33.99 2.74 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.29 -1.506 . . . . 1.0 112.367 -174.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.32 155.11 80.54 Favored Pre-proline 0 CA--C 1.496 -1.114 0 O-C-N 120.601 -1.312 . . . . 1.0 108.119 -173.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -78.12 149.85 25.69 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 CA-C-N 124.241 2.55 . . . . 1.0 114.351 -167.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.336 2.1 pp -61.02 -25.53 66.98 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 125.876 1.67 . . . . 1.0 114.512 172.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 92.3 p -52.7 -29.04 24.54 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 119.366 -2.083 . . . . 1.0 113.823 171.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HZ2' ' HB3' ' B' ' 971' ' ' MET . 11.3 ttpt -65.33 -40.88 94.27 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.632 -1.293 . . . . 1.0 112.74 -174.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.9 -37.73 84.93 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.609 -1.307 . . . . 1.0 113.686 167.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 54.7 ttm -60.81 -42.12 97.04 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.097 -1.627 . . . . 1.0 113.908 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.83 -43.33 99.09 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.909 -1.119 . . . . 1.0 112.395 174.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.41 83.82 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.528 -1.358 . . . . 1.0 114.477 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -60.2 -42.76 95.76 Favored 'General case' 0 N--CA 1.436 -1.161 0 C-N-CA 125.959 1.704 . . . . 1.0 112.033 174.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.4 m -62.15 -41.65 98.49 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 124.793 1.237 . . . . 1.0 113.791 176.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.99 -47.29 75.04 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 114.289 1.218 . . . . 1.0 114.289 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -75.86 -42.99 47.81 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 116.185 1.92 . . . . 1.0 116.185 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -114.07 11.89 17.78 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.868 -1.145 . . . . 1.0 112.551 -161.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.34 43.71 19.43 Favored Glycine 0 CA--C 1.494 -1.244 0 N-CA-C 117.078 1.591 . . . . 1.0 117.078 164.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.4 mt -124.63 156.5 37.4 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 124.334 1.054 . . . . 1.0 111.154 -169.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.5 m -102.2 131.35 48.79 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.543 -1.348 . . . . 1.0 111.01 170.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -65.02 -24.5 67.52 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 116.317 1.969 . . . . 1.0 116.317 -170.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -89.69 -3.46 58.21 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.258 -1.526 . . . . 1.0 112.848 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -100.87 -15.91 17.42 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.715 -1.241 . . . . 1.0 111.849 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.2 pt -114.42 147.09 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 C-N-CA 125.312 1.445 . . . . 1.0 108.322 174.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -137.75 152.22 48.98 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.154 -1.424 . . . . 1.0 107.154 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.8 m-30 -109.4 148.59 30.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-O 123.079 1.418 . . . . 1.0 109.956 -173.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -139.62 140.97 37.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 108.023 -1.103 . . . . 1.0 108.023 -168.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -127.01 115.96 20.02 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.12 -1.437 . . . . 1.0 107.12 171.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t70 59.16 40.11 22.14 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 125.48 1.512 . . . . 1.0 114.117 171.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.71 5.17 90.15 Favored Glycine 0 N--CA 1.438 -1.216 0 N-CA-C 116.173 1.229 . . . . 1.0 116.173 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -117.17 136.67 23.45 Favored Pre-proline 0 N--CA 1.433 -1.278 0 O-C-N 120.291 -1.711 . . . . 1.0 109.97 -173.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -58.51 137.46 80.44 Favored 'Trans proline' 0 N--CA 1.44 -1.631 0 C-N-CA 123.539 2.826 . . . . 1.0 114.558 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.0 pt -117.13 135.68 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 N-CA-C 106.206 -1.776 . . . . 1.0 106.206 171.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -100.59 163.9 12.14 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.363 -1.461 . . . . 1.0 110.232 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.87 -17.55 61.52 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 119.053 -2.279 . . . . 1.0 113.598 -178.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 98.9 m -78.6 -19.78 51.96 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 125.665 1.586 . . . . 1.0 112.53 167.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -76.61 170.7 15.93 Favored 'General case' 0 N--CA 1.432 -1.355 0 O-C-N 119.702 -1.874 . . . . 1.0 112.153 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 77.2 p -149.25 159.07 37.7 Favored Pre-proline 0 CA--C 1.495 -1.154 0 O-C-N 119.861 -1.775 . . . . 1.0 109.556 -158.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -58.04 -35.05 99.04 Favored 'Trans proline' 0 N--CA 1.439 -1.69 0 C-N-CA 123.334 2.689 . . . . 1.0 114.94 168.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.97 83.26 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 113.916 1.08 . . . . 1.0 113.916 176.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -68.94 -42.52 76.62 Favored 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 124.845 1.258 . . . . 1.0 113.56 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -86.01 -8.47 57.93 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 121.926 0.87 . . . . 1.0 111.073 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 66.7 44.35 2.21 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 127.196 2.199 . . . . 1.0 114.259 175.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 60.3 mtt -62.05 154.24 27.38 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 128.598 2.759 . . . . 1.0 113.398 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -113.3 178.23 4.35 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 107.981 -1.118 . . . . 1.0 107.981 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.459 10.2 p-10 -54.23 -26.5 28.9 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 117.164 2.283 . . . . 1.0 117.164 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -138.28 58.5 1.67 Allowed 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 125.887 1.675 . . . . 1.0 112.069 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.89 161.61 29.59 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 116.233 1.938 . . . . 1.0 116.233 -171.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 61.2 m -129.04 116.42 19.28 Favored 'General case' 0 CA--C 1.497 -1.065 0 C-N-CA 125.011 1.325 . . . . 1.0 111.971 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.7 mm -120.74 140.91 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 C-N-CA 127.974 2.51 . . . . 1.0 109.842 -170.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -110.93 143.86 40.91 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 119.528 -1.983 . . . . 1.0 108.918 -167.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.4 t -108.66 126.25 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.214 0 O-C-N 120.955 -1.091 . . . . 1.0 108.762 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -113.6 134.84 54.48 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 123.403 1.573 . . . . 1.0 107.543 172.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -106.33 124.65 49.92 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.923 -1.111 . . . . 1.0 110.751 -161.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -108.68 -10.76 15.15 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 120.777 -1.202 . . . . 1.0 112.597 -174.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -16.65 121.14 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 130.529 3.532 . . . . 1.0 119.483 175.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . 0.28 6.3 m 65.15 53.04 1.39 Allowed 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 126.885 2.074 . . . . 1.0 111.677 -176.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -112.88 -18.83 7.16 Favored Glycine 0 CA--C 1.493 -1.318 0 O-C-N 121.262 -0.899 . . . . 1.0 113.97 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.805 0 CA-C-O 118.393 -1.226 . . . . 1.0 111.425 177.118 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 N-CA-C 113.485 0.154 . . . . 1.0 113.485 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -74.84 -46.6 40.54 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 N-CA-C 115.285 1.587 . . . . 1.0 115.285 -165.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.4 mt -113.08 119.01 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 C-N-CA 125.11 1.364 . . . . 1.0 110.18 -173.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -102.02 115.65 31.0 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.06 -1.65 . . . . 1.0 106.808 165.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.0 166.29 10.83 Favored 'General case' 0 CA--C 1.497 -1.072 0 CA-C-N 121.667 2.031 . . . . 1.0 114.581 -174.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 4.0 t -146.81 179.99 7.19 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.55 1.14 . . . . 1.0 110.531 -175.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 971' ' ' MET . . . . . 0.408 ' HB3' ' HZ2' ' A' ' 42' ' ' LYS . 42.3 ttp 101.72 50.88 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.043 0 C-N-CA 130.732 3.613 . . . . 1.0 107.728 -156.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -153.97 -10.97 0.14 Allowed 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 114.026 1.121 . . . . 1.0 114.026 -163.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 59.8 -176.76 0.1 Allowed 'General case' 0 N--CA 1.435 -1.177 0 CA-C-O 122.532 1.158 . . . . 1.0 113.329 -155.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.61 134.04 47.25 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 119.453 -2.029 . . . . 1.0 114.164 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.619 0 C-N-CA 125.396 1.478 . . . . 1.0 111.993 177.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 119.302 -0.38 . . . . 1.0 110.771 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.46 7.86 36.67 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 119.616 -1.927 . . . . 1.0 112.946 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.42 -38.04 89.61 Favored 'General case' 0 N--CA 1.433 -1.289 0 C-N-CA 125.88 1.672 . . . . 1.0 114.704 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -122.76 152.22 40.84 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.74 -1.225 . . . . 1.0 109.977 171.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -64.74 152.18 90.81 Favored Pre-proline 0 N--CA 1.435 -1.215 0 C-N-CA 126.743 2.017 . . . . 1.0 113.871 -175.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -44.16 141.85 4.47 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 125.02 3.813 . . . . 1.0 118.223 173.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -65.21 128.12 34.49 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 113.068 0.766 . . . . 1.0 113.068 173.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 59.44 37.19 23.19 Favored 'General case' 0 N--CA 1.436 -1.13 0 C-N-CA 126.656 1.982 . . . . 1.0 116.03 -177.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.28 160.13 13.71 Favored Glycine 0 N--CA 1.438 -1.203 0 N-CA-C 117.031 1.572 . . . . 1.0 117.031 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.6 t -122.42 137.22 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.123 0 C-N-CA 124.659 1.184 . . . . 1.0 109.983 -177.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -134.01 171.5 14.11 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 125.441 1.496 . . . . 1.0 108.68 -176.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.8 m -67.35 128.02 34.84 Favored 'General case' 0 N--CA 1.439 -1.018 0 O-C-N 119.983 -1.698 . . . . 1.0 111.137 168.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -107.29 25.19 11.73 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 119.91 -1.743 . . . . 1.0 112.347 -168.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -62.65 -30.85 71.68 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 126.471 1.908 . . . . 1.0 115.496 -176.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -99.76 0.61 42.02 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.604 -1.31 . . . . 1.0 112.48 178.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -91.49 20.39 5.37 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 115.712 1.745 . . . . 1.0 115.712 -160.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -56.23 145.19 27.29 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 117.141 2.274 . . . . 1.0 117.141 173.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.3 pt -129.57 160.66 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 129.346 3.058 . . . . 1.0 106.153 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.75 144.79 44.98 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.925 -2.985 . . . . 1.0 111.027 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.65 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -131.52 151.38 51.63 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.286 -2.134 . . . . 1.0 107.992 170.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 7.5 ptpt -121.38 150.61 41.23 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 119.908 -1.745 . . . . 1.0 110.697 172.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.52 131.9 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 N-CA-C 108.314 -0.995 . . . . 1.0 108.314 174.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.75 132.43 54.61 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 124.759 1.224 . . . . 1.0 111.027 -174.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 160.2 -134.55 3.69 Favored Glycine 0 CA--C 1.49 -1.49 0 N-CA-C 109.236 -1.546 . . . . 1.0 109.236 176.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 38.63 49.84 1.5 Allowed 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 118.252 2.686 . . . . 1.0 118.252 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 70.75 39.76 1.06 Allowed 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 126.499 1.92 . . . . 1.0 112.453 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.87 23.77 19.55 Favored Glycine 0 CA--C 1.492 -1.345 0 C-N-CA 124.586 1.088 . . . . 1.0 114.022 166.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.6 m -107.86 157.76 17.9 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.633 1.573 . . . . 1.0 111.0 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -139.87 137.22 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.143 0 O-C-N 120.523 -1.361 . . . . 1.0 109.501 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.401 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.292 0.3 OUTLIER -129.31 138.72 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 O-C-N 119.846 -1.784 . . . . 1.0 111.208 166.4 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.407 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -116.31 147.21 41.77 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-O 125.393 2.521 . . . . 1.0 114.425 176.921 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -127.23 140.58 52.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.331 -1.729 . . . . 1.0 106.331 -173.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -101.23 115.85 31.44 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.835 2.454 . . . . 1.0 107.164 176.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.65 HG21 HD22 ' A' ' 20' ' ' LEU . 9.6 tt -137.7 154.72 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 CA-C-O 125.57 2.605 . . . . 1.0 109.362 -155.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 mtpp -108.74 164.16 12.62 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 110.967 -2.833 . . . . 1.0 111.775 -165.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -59.41 -38.01 79.53 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.989 1.848 . . . . 1.0 115.989 -160.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 -116.65 33.73 5.43 Favored 'General case' 0 N--CA 1.432 -1.35 0 O-C-N 120.958 -1.089 . . . . 1.0 111.759 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.8 m -90.77 124.85 61.1 Favored Pre-proline 0 N--CA 1.438 -1.072 0 O-C-N 120.654 -1.279 . . . . 1.0 109.938 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.73 159.82 52.02 Favored 'Trans proline' 0 N--CA 1.441 -1.615 0 C-N-CA 122.988 2.459 . . . . 1.0 114.615 175.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.359 1.0 OUTLIER -64.99 -25.79 68.01 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 114.805 1.409 . . . . 1.0 114.805 179.841 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.8 p -52.77 -29.24 26.18 Favored 'General case' 0 N--CA 1.437 -1.108 0 O-C-N 120.097 -1.627 . . . . 1.0 115.379 168.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.04 -42.9 68.9 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.042 -1.661 . . . . 1.0 112.572 -175.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.429 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -65.77 -35.68 81.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.67 -1.269 . . . . 1.0 113.527 172.985 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.9 ttm -61.75 -43.1 99.51 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 120.233 -1.542 . . . . 1.0 113.771 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -42.75 99.3 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 120.926 -1.108 . . . . 1.0 112.969 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.2 86.79 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.515 1.126 . . . . 1.0 113.759 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.38 -42.59 98.96 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.574 1.55 . . . . 1.0 112.212 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.2 m -61.88 -43.69 98.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.528 1.131 . . . . 1.0 113.525 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.58 -48.66 68.89 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.667 1.358 . . . . 1.0 114.667 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.1 -43.18 62.1 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 119.886 -1.759 . . . . 1.0 115.558 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -113.58 8.95 17.85 Favored 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 121.129 -0.982 . . . . 1.0 112.389 -165.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.63 9.84 85.11 Favored Glycine 0 CA--C 1.494 -1.267 0 N-CA-C 116.815 1.486 . . . . 1.0 116.815 162.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.7 mt -81.61 166.34 20.29 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 125.323 1.449 . . . . 1.0 113.238 -174.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -102.21 139.64 37.56 Favored 'General case' 0 CA--C 1.494 -1.21 0 O-C-N 120.563 -1.336 . . . . 1.0 112.245 170.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -29.25 70.63 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.1 1.36 . . . . 1.0 113.484 -178.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.6 ptt180 -95.0 -6.94 41.15 Favored 'General case' 0 N--CA 1.433 -1.291 0 C-N-CA 124.185 0.994 . . . . 1.0 112.771 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -94.6 -22.53 18.12 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.185 -1.572 . . . . 1.0 111.065 174.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 18.9 pt -110.2 145.03 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 CA-C-O 121.475 0.655 . . . . 1.0 112.368 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -138.17 154.95 49.13 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.403 -1.436 . . . . 1.0 109.176 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -115.41 148.67 39.08 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.502 -1.373 . . . . 1.0 112.803 -169.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.75 151.82 48.52 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 126.686 1.994 . . . . 1.0 109.133 175.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -130.84 116.19 17.6 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 108.797 -0.816 . . . . 1.0 108.797 167.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 37.5 t0 55.08 44.07 28.62 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 125.385 1.474 . . . . 1.0 113.31 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.79 2.43 81.36 Favored Glycine 0 N--CA 1.437 -1.288 0 O-C-N 120.314 -1.491 . . . . 1.0 115.924 -177.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -108.93 128.78 24.85 Favored Pre-proline 0 N--CA 1.435 -1.194 0 O-C-N 120.498 -1.59 . . . . 1.0 109.779 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -53.06 135.3 58.73 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 123.469 2.779 . . . . 1.0 116.435 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 pt -119.98 141.4 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.249 -1.389 . . . . 1.0 107.249 174.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.76 160.46 16.71 Favored 'General case' 0 N--CA 1.435 -1.224 0 O-C-N 120.727 -1.233 . . . . 1.0 109.182 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.77 -30.07 70.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 119.82 -1.8 . . . . 1.0 114.14 -173.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.1 m -96.58 6.25 49.1 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.36 1.464 . . . . 1.0 112.489 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -71.2 178.84 3.11 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 118.411 -2.68 . . . . 1.0 113.205 173.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.0 p -120.79 151.96 55.32 Favored Pre-proline 0 CA--C 1.498 -1.019 0 O-C-N 120.151 -1.593 . . . . 1.0 113.557 -161.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -56.4 -30.83 83.14 Favored 'Trans proline' 0 N--CA 1.442 -1.5 0 C-N-CA 123.806 3.004 . . . . 1.0 116.637 170.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.99 87.97 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 114.141 1.163 . . . . 1.0 114.141 173.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.21 -36.76 82.37 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 126.414 1.886 . . . . 1.0 112.793 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.657 HD11 HD12 ' A' ' 84' ' ' ILE . 62.3 tp -81.6 -8.49 59.72 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-O 122.795 1.283 . . . . 1.0 111.399 178.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 56.58 48.26 16.93 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 127.048 2.139 . . . . 1.0 113.376 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 93.7 mtp -62.19 143.48 56.72 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 115.73 1.752 . . . . 1.0 115.73 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -148.57 179.65 7.65 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 106.103 -1.814 . . . . 1.0 106.103 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.284 2.2 p30 -54.86 -26.57 36.38 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 116.655 2.094 . . . . 1.0 116.655 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -135.19 105.19 6.2 Favored 'General case' 0 N--CA 1.436 -1.166 0 C-N-CA 125.446 1.498 . . . . 1.0 108.219 162.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.439 ' HB3' ' HB2' ' A' ' 20' ' ' LEU . 5.0 t0 -100.18 158.73 15.65 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.714 -1.241 . . . . 1.0 112.135 164.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.4 m -136.35 115.29 12.25 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 124.251 1.02 . . . . 1.0 110.57 -176.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.657 HD12 HD11 ' A' ' 76' ' ' LEU . 10.0 mm -120.32 140.81 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.962 2.505 . . . . 1.0 109.219 -166.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -110.79 142.27 43.0 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 119.072 -2.268 . . . . 1.0 108.425 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.7 p -120.38 136.71 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.172 0 C-N-CA 125.114 1.366 . . . . 1.0 109.305 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -133.74 145.13 49.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 124.438 1.095 . . . . 1.0 108.067 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -105.83 132.59 51.76 Favored 'General case' 0 N--CA 1.433 -1.278 0 O-C-N 120.551 -1.343 . . . . 1.0 113.28 -169.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -114.14 -7.0 13.05 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 124.974 1.31 . . . . 1.0 112.755 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . 0.333 3.8 pt20 59.41 11.98 2.48 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 119.772 3.249 . . . . 1.0 119.772 172.065 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 21.5 m -60.62 129.78 43.26 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 116.102 1.89 . . . . 1.0 116.102 -177.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.35 -48.47 4.02 Favored Glycine 0 N--CA 1.436 -1.321 0 C-N-CA 125.078 1.323 . . . . 1.0 116.402 156.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.733 0 C-N-CA 125.173 1.368 . . . . 1.0 110.052 -176.32 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.879 0 N-CA-C 113.733 0.253 . . . . 1.0 113.733 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 966' ' ' VAL . . . . . 0.401 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.333 0.2 OUTLIER -75.83 -54.2 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 116.143 1.905 . . . . 1.0 116.143 179.562 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -112.37 113.47 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 O-C-N 121.51 -0.743 . . . . 1.0 109.495 -168.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.04 122.45 44.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.662 -1.899 . . . . 1.0 109.667 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 66.8 mt -95.58 153.37 17.75 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 115.748 1.758 . . . . 1.0 115.748 -172.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 32.2 p -111.91 -10.11 14.0 Favored 'General case' 0 CA--C 1.497 -1.062 0 C-N-CA 126.461 1.904 . . . . 1.0 112.885 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 27.7 ttt -80.82 120.28 24.47 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 119.965 -1.709 . . . . 1.0 113.242 -177.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . 0.293 27.0 t0 118.24 90.97 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 131.007 3.723 . . . . 1.0 109.827 175.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 69.15 36.66 2.34 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 127.343 2.257 . . . . 1.0 112.732 178.439 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 47.88 -153.68 0.08 Allowed 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 126.433 1.893 . . . . 1.0 113.514 -167.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 . . . . . 0 N--CA 1.423 -1.814 0 C-N-CA 126.143 1.777 . . . . 1.0 110.602 171.133 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ptt? . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 114.187 1.18 . . . . 1.0 114.187 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.02 -42.49 80.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 114.969 1.47 . . . . 1.0 114.969 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -119.78 -139.04 0.34 Allowed 'General case' 0 N--CA 1.433 -1.301 0 C-N-CA 124.863 1.265 . . . . 1.0 107.805 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -99.7 -4.79 30.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.11 -1.619 . . . . 1.0 113.349 -175.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -93.66 126.04 51.31 Favored Pre-proline 0 N--CA 1.435 -1.187 0 O-C-N 120.729 -1.232 . . . . 1.0 113.055 176.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -53.24 165.78 1.3 Allowed 'Trans proline' 0 N--CA 1.442 -1.513 0 C-N-CA 125.273 3.982 . . . . 1.0 118.698 168.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.9 pttt -132.28 169.68 16.13 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.846 0.832 . . . . 1.0 112.36 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -139.6 157.0 46.54 Favored 'General case' 0 N--CA 1.434 -1.257 0 C-N-CA 125.447 1.499 . . . . 1.0 107.365 172.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.06 88.94 Favored Glycine 0 N--CA 1.437 -1.259 0 O-C-N 120.422 -1.424 . . . . 1.0 114.589 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.0 m -108.79 7.32 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 C-N-CA 125.832 1.653 . . . . 1.0 111.934 -177.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -132.25 135.01 45.97 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 106.455 -1.683 . . . . 1.0 106.455 173.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.9 t -151.12 152.15 32.97 Favored 'General case' 0 CA--C 1.496 -1.103 0 CA-C-O 122.457 1.122 . . . . 1.0 110.894 -172.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -92.51 -8.39 44.66 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 124.94 1.296 . . . . 1.0 111.069 174.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 60.34 39.53 18.65 Favored 'General case' 0 N--CA 1.436 -1.159 0 C-N-CA 128.096 2.559 . . . . 1.0 114.914 -178.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -85.1 142.85 29.23 Favored 'General case' 0 N--CA 1.435 -1.176 0 O-C-N 119.804 -1.81 . . . . 1.0 111.418 177.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -102.28 7.42 40.68 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 122.966 1.365 . . . . 1.0 112.626 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -95.7 133.86 39.29 Favored 'General case' 0 N--CA 1.432 -1.357 0 C-N-CA 125.499 1.52 . . . . 1.0 108.957 152.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.6 pt -138.19 160.72 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 C-N-CA 129.975 3.31 . . . . 1.0 106.198 -171.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -117.89 144.89 45.04 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 119.353 -2.092 . . . . 1.0 110.712 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.685 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -134.03 160.83 36.56 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 118.761 -2.462 . . . . 1.0 108.334 173.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -131.7 150.66 52.08 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 119.985 -1.697 . . . . 1.0 112.914 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.477 HG22 ' HB ' ' A' ' 84' ' ' ILE . 47.0 t -119.12 119.28 60.35 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 N-CA-C 107.407 -1.331 . . . . 1.0 107.407 176.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -113.55 130.14 56.42 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.79 0.805 . . . . 1.0 111.918 -170.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -86.95 178.28 48.27 Favored Glycine 0 N--CA 1.433 -1.502 0 CA-C-O 122.948 1.305 . . . . 1.0 115.32 -175.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -85.45 -22.64 28.2 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 124.661 1.185 . . . . 1.0 112.24 -177.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -83.31 -18.14 40.04 Favored 'General case' 0 N--CA 1.433 -1.278 0 O-C-N 120.959 -1.088 . . . . 1.0 111.672 178.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.89 -2.93 6.41 Favored Glycine 0 CA--C 1.492 -1.405 0 O-C-N 120.896 -1.127 . . . . 1.0 114.915 161.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.7 m -109.89 157.73 18.92 Favored 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 119.269 1.535 . . . . 1.0 112.547 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.9 p -139.88 140.98 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 C-N-CA 125.528 1.531 . . . . 1.0 110.176 -165.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.72 HG22 HG11 ' B' ' 966' ' ' VAL . 0.9 OUTLIER -119.23 138.74 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.119 0 O-C-N 120.868 -1.145 . . . . 1.0 108.983 174.13 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.435 ' H ' HG21 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -112.68 160.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 126.729 3.157 . . . . 1.0 114.42 179.934 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.437 ' HB2' HD23 ' A' ' 20' ' ' LEU . 8.3 m-85 -145.1 140.64 28.18 Favored 'General case' 0 N--CA 1.428 -1.548 0 O-C-N 118.838 -2.414 . . . . 1.0 107.883 -165.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.277 30.0 ttpt -104.98 115.89 31.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.315 2.246 . . . . 1.0 113.994 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.685 HG21 HD22 ' A' ' 20' ' ' LEU . 6.3 tt -142.67 154.67 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.356 0 CA-C-O 124.007 1.86 . . . . 1.0 110.612 -154.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.438 ' HE3' ' HA ' ' B' ' 973' ' ' ASP 0.266 3.7 mppt? -107.19 165.79 11.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 113.843 -1.526 . . . . 1.0 113.668 -175.783 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -63.28 -38.05 89.66 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 -160.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -99.14 -4.07 33.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.607 -1.308 . . . . 1.0 112.498 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 m -60.45 134.41 91.34 Favored Pre-proline 0 N--CA 1.437 -1.123 0 C-N-CA 126.294 1.838 . . . . 1.0 113.576 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.73 160.73 37.47 Favored 'Trans proline' 0 N--CA 1.441 -1.6 0 C-N-CA 122.867 2.378 . . . . 1.0 113.712 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.375 1.0 OUTLIER -65.58 -25.56 67.46 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 126.101 1.76 . . . . 1.0 114.066 178.613 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.2 p -52.8 -29.02 25.21 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 115.822 1.786 . . . . 1.0 115.822 173.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -65.39 -43.79 89.58 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 119.962 1.256 . . . . 1.0 114.079 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.545 HD22 HD21 ' A' ' 20' ' ' LEU . 0.5 OUTLIER -69.69 -31.06 68.88 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.052 -1.655 . . . . 1.0 112.693 177.672 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 tpp -60.43 -43.57 96.66 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 120.703 -1.248 . . . . 1.0 113.7 171.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -61.57 -43.35 99.03 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.696 -1.252 . . . . 1.0 113.381 171.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.38 -34.04 73.94 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.739 -1.85 . . . . 1.0 114.147 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.4 -36.88 79.15 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 127.217 2.207 . . . . 1.0 111.56 170.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 53' ' ' LEU . 77.7 m -69.9 -30.76 68.26 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 127.454 2.302 . . . . 1.0 113.671 170.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -67.07 -52.65 39.45 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 119.12 -2.237 . . . . 1.0 113.386 165.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -78.92 -43.44 24.75 Favored 'General case' 0 N--CA 1.437 -1.117 1 N-CA-C 125.339 5.311 . . . . 1.0 125.339 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -160.98 -18.03 0.05 Allowed 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 119.955 3.317 . . . . 1.0 119.955 -157.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.27 -37.56 4.29 Favored Glycine 0 CA--C 1.492 -1.375 0 O-C-N 118.55 -2.594 . . . . 1.0 110.83 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.461 ' HA ' ' HA ' ' A' ' 48' ' ' CYS 0.884 0.1 OUTLIER 57.16 -28.49 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.397 2 N-CA-C 128.003 6.297 . . . . 1.0 128.003 161.769 . . . . . . . . 5 4 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.8 m -102.4 123.65 46.55 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 105.94 -1.874 . . . . 1.0 105.94 154.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -63.76 -18.52 64.15 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.689 -1.257 . . . . 1.0 112.564 169.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -90.86 -3.52 57.3 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 113.307 0.855 . . . . 1.0 113.307 174.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -82.07 -38.54 24.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 120.009 -1.682 . . . . 1.0 112.527 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.6 pp -128.03 141.95 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.125 0 O-C-N 121.295 -0.878 . . . . 1.0 112.959 -165.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 155.06 48.98 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.549 1.539 . . . . 1.0 108.738 174.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -106.13 144.96 32.1 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.677 -1.264 . . . . 1.0 112.578 -168.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -126.39 145.18 50.56 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 126.284 1.834 . . . . 1.0 112.771 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -116.38 111.74 20.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.657 1.183 . . . . 1.0 108.549 168.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 t70 48.06 50.39 16.06 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 126.72 2.008 . . . . 1.0 114.574 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.73 0.89 89.9 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 117.544 1.778 . . . . 1.0 117.544 -178.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -118.3 133.46 23.49 Favored Pre-proline 0 N--CA 1.435 -1.206 0 CA-C-N 120.549 2.175 . . . . 1.0 110.528 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_exo -48.0 135.22 23.87 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 124.424 3.416 . . . . 1.0 117.55 168.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.6 pt -116.58 154.97 18.13 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 C-N-CA 124.826 1.251 . . . . 1.0 107.849 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -103.33 160.49 14.64 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.927 -1.108 . . . . 1.0 110.096 -175.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -63.18 -28.2 69.89 Favored 'General case' 0 CA--C 1.496 -1.106 0 O-C-N 119.554 -1.966 . . . . 1.0 114.04 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.3 m -92.29 -0.26 57.41 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 120.98 -1.075 . . . . 1.0 112.022 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -67.84 174.59 3.55 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.489 -2.007 . . . . 1.0 113.54 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.6 p -111.01 150.52 42.03 Favored Pre-proline 0 N--CA 1.438 -1.069 0 O-C-N 120.275 -1.515 . . . . 1.0 112.32 -156.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -58.01 -32.98 96.66 Favored 'Trans proline' 0 N--CA 1.44 -1.62 0 C-N-CA 122.959 2.439 . . . . 1.0 115.585 170.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.79 -45.37 82.65 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -66.66 -34.36 77.69 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.755 1.622 . . . . 1.0 113.595 -177.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 42.3 tp -95.33 -5.15 44.12 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.951 1.701 . . . . 1.0 112.023 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 59.47 45.33 13.71 Favored 'General case' 0 N--CA 1.436 -1.131 0 C-N-CA 127.468 2.307 . . . . 1.0 114.817 175.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.0 mtp -65.76 135.96 55.6 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 116.503 2.038 . . . . 1.0 116.503 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -150.48 -173.77 4.56 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.66 1.584 . . . . 1.0 108.516 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -55.77 -26.72 47.25 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 118.157 2.651 . . . . 1.0 118.157 -172.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -141.49 83.15 1.85 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.747 1.219 . . . . 1.0 108.311 167.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -85.59 159.6 19.83 Favored 'General case' 0 CA--C 1.498 -1.058 0 O-C-N 120.667 -1.271 . . . . 1.0 112.538 175.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -127.59 128.2 45.16 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 124.481 1.112 . . . . 1.0 109.843 174.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.477 ' HB ' HG22 ' A' ' 22' ' ' VAL . 77.1 mt -118.31 140.78 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 129.256 3.022 . . . . 1.0 106.605 178.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -110.75 145.51 37.96 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 119.526 -1.984 . . . . 1.0 105.893 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -108.56 139.73 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.302 0 O-C-N 120.721 -1.237 . . . . 1.0 108.215 -171.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -119.3 135.26 54.79 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-O 123.054 1.407 . . . . 1.0 108.673 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 62.4 tp60 -81.99 120.58 25.43 Favored 'General case' 0 N--CA 1.432 -1.336 0 C-N-CA 125.344 1.458 . . . . 1.0 110.148 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -89.88 -152.69 0.26 Allowed 'General case' 0 N--CA 1.433 -1.311 0 O-C-N 121.295 -0.878 . . . . 1.0 110.847 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 57.97 44.86 19.01 Favored 'General case' 0 N--CA 1.437 -1.079 0 C-N-CA 125.14 1.376 . . . . 1.0 114.024 -175.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 42.3 p -62.85 147.04 51.29 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 115.117 1.525 . . . . 1.0 115.117 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -94.36 -148.44 23.97 Favored Glycine 0 N--CA 1.436 -1.349 0 C-N-CA 124.801 1.191 . . . . 1.0 112.904 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.714 0 O-C-N 121.018 -1.284 . . . . 1.0 111.165 179.241 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.999 0 N-CA-C 112.567 -0.213 . . . . 1.0 112.567 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 966' ' ' VAL . . . . . 0.72 HG11 HG22 ' A' ' 30' ' ' VAL . 28.4 t -89.36 -102.63 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 O-C-N 121.078 -1.248 . . . . 1.0 111.943 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 967' ' ' ILE . . . . . 0.415 ' N ' HG12 ' B' ' 966' ' ' VAL . 0.4 OUTLIER -95.44 132.04 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 O-C-N 120.803 -1.185 . . . . 1.0 111.892 -157.092 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -102.0 107.95 19.24 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 125.509 1.524 . . . . 1.0 108.397 173.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.589 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.5 OUTLIER -108.01 151.33 25.97 Favored 'General case' 0 CA--C 1.494 -1.2 0 O-C-N 119.741 -1.849 . . . . 1.0 114.85 -176.814 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 44.9 p -84.61 174.18 10.18 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 127.513 2.325 . . . . 1.0 111.782 177.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.256 24.3 ttt 89.67 123.29 0.03 OUTLIER 'General case' 0 CA--C 1.496 -1.11 0 C-N-CA 127.891 2.476 . . . . 1.0 111.138 175.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 15.4 t0 66.88 48.42 1.32 Allowed 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.077 1.751 . . . . 1.0 111.787 -164.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 973' ' ' ASP . . . . . 0.438 ' HA ' ' HE3' ' A' ' 35' ' ' LYS . 32.5 m-20 -78.06 83.18 4.36 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 117.45 2.389 . . . . 1.0 117.45 -163.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -65.62 -50.18 65.99 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.689 -1.257 . . . . 1.0 111.375 152.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 . . . . . 0 N--CA 1.427 -1.602 0 C-N-CA 127.194 2.197 . . . . 1.0 112.206 176.487 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.1 mmt . . . . . 0 N--CA 1.481 1.113 0 CA-C-O 119.803 -0.142 . . . . 1.0 111.366 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.3 -36.36 81.35 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 119.9 -1.75 . . . . 1.0 114.021 169.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -62.96 -46.84 85.84 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 127.061 2.144 . . . . 1.0 114.817 177.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -155.94 145.63 21.11 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.488 -1.671 . . . . 1.0 106.488 175.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -65.94 147.0 99.0 Favored Pre-proline 0 N--CA 1.437 -1.08 0 O-C-N 120.07 -1.644 . . . . 1.0 114.764 -176.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -75.07 145.98 31.86 Favored 'Trans proline' 0 N--CA 1.44 -1.647 0 C-N-CA 122.614 2.209 . . . . 1.0 112.195 173.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -137.16 168.01 20.44 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 124.605 1.162 . . . . 1.0 110.237 -177.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -59.64 146.51 40.81 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 120.605 -1.309 . . . . 1.0 114.331 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.58 -2.13 84.32 Favored Glycine 0 N--CA 1.436 -1.328 0 N-CA-C 117.313 1.685 . . . . 1.0 117.313 -169.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.1 p -57.02 139.77 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.144 0 C-N-CA 126.682 1.993 . . . . 1.0 115.313 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -117.4 128.69 55.27 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.211 -1.556 . . . . 1.0 109.757 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.5 p -105.67 -1.14 24.91 Favored 'General case' 0 CA--C 1.495 -1.163 0 O-C-N 120.169 -1.582 . . . . 1.0 112.85 -177.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -60.3 154.13 20.87 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 125.703 1.601 . . . . 1.0 114.435 171.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -62.89 149.67 43.9 Favored 'General case' 0 N--CA 1.436 -1.161 0 O-C-N 120.658 -1.276 . . . . 1.0 112.693 171.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -92.72 12.78 22.23 Favored 'General case' 0 N--CA 1.436 -1.151 0 O-C-N 120.213 -1.554 . . . . 1.0 114.66 -165.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.5 p-10 -87.33 -15.1 38.93 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 116.349 1.981 . . . . 1.0 116.349 -172.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.0 p-80 -121.33 161.91 21.23 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 117.475 2.398 . . . . 1.0 117.475 -171.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -132.68 160.73 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 C-N-CA 130.98 3.712 . . . . 1.0 105.096 173.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -112.25 144.77 41.1 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.285 -2.135 . . . . 1.0 109.757 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -137.43 160.44 39.1 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.263 -2.148 . . . . 1.0 105.854 177.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -138.05 150.68 47.14 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 119.556 -1.965 . . . . 1.0 111.416 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.429 HG22 ' CE1' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -108.77 132.82 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.612 0 C-N-CA 125.781 1.632 . . . . 1.0 108.21 174.896 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.36 130.15 56.33 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 123.976 0.91 . . . . 1.0 109.419 173.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -90.12 -176.51 45.0 Favored Glycine 0 N--CA 1.435 -1.391 0 CA-C-O 122.566 1.092 . . . . 1.0 114.992 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -61.55 -33.63 74.17 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 126.383 1.873 . . . . 1.0 112.869 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -90.83 0.56 57.43 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 120.704 -1.248 . . . . 1.0 112.771 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.92 4.15 90.38 Favored Glycine 0 N--CA 1.436 -1.333 0 O-C-N 120.51 -1.369 . . . . 1.0 115.535 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.5 m -70.32 140.71 52.31 Favored 'General case' 0 CA--C 1.495 -1.158 0 O-C-N 120.593 -1.534 . . . . 1.0 110.872 171.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.4 p -134.01 133.5 56.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 O-C-N 121.326 -0.859 . . . . 1.0 112.231 -169.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.658 HG22 HG11 ' B' ' 966' ' ' VAL 0.26 0.7 OUTLIER -129.24 138.78 53.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 O-C-N 120.056 -1.653 . . . . 1.0 111.616 166.897 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.1 161.6 14.61 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 126.629 3.109 . . . . 1.0 115.686 173.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.429 ' CE1' HG22 ' A' ' 22' ' ' VAL . 3.6 m-85 -145.11 157.65 44.04 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.255 -2.778 . . . . 1.0 107.139 -173.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.268 24.1 ttpt -120.52 115.85 24.25 Favored 'General case' 0 N--CA 1.434 -1.238 0 C-N-CA 124.813 1.245 . . . . 1.0 109.686 -176.468 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 18.6 tt -148.56 154.74 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 CA-C-O 125.121 2.391 . . . . 1.0 112.028 -162.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.49 163.29 14.69 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 111.476 -2.602 . . . . 1.0 111.741 -177.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 71.0 mtt85 -71.29 -37.97 71.82 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 116.441 2.015 . . . . 1.0 116.441 -164.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -98.73 -11.51 21.85 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.581 -1.325 . . . . 1.0 112.33 -175.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.4 m -59.66 137.1 89.82 Favored Pre-proline 0 N--CA 1.435 -1.192 0 C-N-CA 126.291 1.836 . . . . 1.0 112.73 170.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -71.36 155.25 60.51 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 123.642 2.336 . . . . 1.0 114.994 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.399 2.0 pp -62.01 -25.57 67.73 Favored 'General case' 0 N--CA 1.434 -1.273 0 C-N-CA 125.539 1.535 . . . . 1.0 114.67 174.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.0 p -52.64 -29.11 24.46 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.281 -2.137 . . . . 1.0 114.86 170.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.82 -41.73 87.01 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 119.97 -1.707 . . . . 1.0 112.605 -174.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -37.28 84.96 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.78 -1.2 . . . . 1.0 113.85 170.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.0 ttm -60.2 -42.55 95.35 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 120.243 -1.536 . . . . 1.0 113.771 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.96 -43.62 98.47 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.539 -1.351 . . . . 1.0 112.497 172.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.73 -35.12 79.37 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 114.753 1.39 . . . . 1.0 114.753 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.55 -43.81 89.43 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 127.355 2.262 . . . . 1.0 111.767 174.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.8 m -62.25 -42.36 99.26 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 124.907 1.283 . . . . 1.0 113.531 173.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.09 -46.99 72.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 115.054 1.501 . . . . 1.0 115.054 176.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.465 ' HB2' HD11 ' B' ' 967' ' ' ILE . 2.8 mtt180 -75.6 -43.2 49.34 Favored 'General case' 0 CA--C 1.495 -1.136 0 O-C-N 120.276 -1.515 . . . . 1.0 114.722 178.081 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -114.98 8.93 15.94 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.12 0.785 . . . . 1.0 113.12 -162.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.14 9.47 86.07 Favored Glycine 0 N--CA 1.437 -1.285 0 N-CA-C 117.355 1.702 . . . . 1.0 117.355 161.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -85.82 162.77 18.5 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 121.321 -1.105 . . . . 1.0 113.446 -174.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.9 m -102.32 129.41 48.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 124.307 1.043 . . . . 1.0 110.307 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -66.54 -22.52 66.16 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 116.47 2.026 . . . . 1.0 116.47 -171.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -90.47 -1.59 57.9 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.317 -1.489 . . . . 1.0 112.759 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -100.49 -10.37 21.16 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.775 -1.203 . . . . 1.0 111.644 177.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -122.92 146.58 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 O-C-N 120.581 -1.324 . . . . 1.0 110.03 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -138.24 154.97 49.06 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.698 -1.223 . . . . 1.0 107.698 171.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -113.97 148.61 36.6 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.655 1.217 . . . . 1.0 110.74 -173.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -137.41 156.89 47.66 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.642 -1.286 . . . . 1.0 108.429 173.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -131.85 113.87 14.0 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 120.987 -1.071 . . . . 1.0 108.522 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 27.0 t0 53.5 46.52 26.0 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 125.534 1.534 . . . . 1.0 113.473 -177.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.65 5.78 86.42 Favored Glycine 0 N--CA 1.436 -1.32 0 O-C-N 120.209 -1.557 . . . . 1.0 116.838 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -119.12 133.14 23.73 Favored Pre-proline 0 N--CA 1.436 -1.136 0 CA-C-N 119.589 1.695 . . . . 1.0 110.137 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -73.43 142.24 32.89 Favored 'Trans proline' 0 C--N 1.308 -1.583 0 CA-C-N 124.173 2.526 . . . . 1.0 113.147 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.0 pt -120.13 145.43 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 C-N-CA 124.931 1.292 . . . . 1.0 109.968 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -109.8 162.89 14.03 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.568 -1.332 . . . . 1.0 111.001 -165.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -70.87 -13.93 62.21 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.738 -1.851 . . . . 1.0 112.796 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -83.07 -14.88 52.89 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 126.874 2.07 . . . . 1.0 112.656 169.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.87 172.24 11.56 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.744 -1.848 . . . . 1.0 111.634 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 82.7 p -147.18 157.25 46.2 Favored Pre-proline 0 CA--C 1.496 -1.097 0 O-C-N 119.962 -1.711 . . . . 1.0 110.202 -162.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -59.85 -32.53 95.49 Favored 'Trans proline' 0 N--CA 1.439 -1.685 0 C-N-CA 123.259 2.639 . . . . 1.0 115.17 170.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.59 -46.05 84.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 113.477 0.918 . . . . 1.0 113.477 175.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -68.22 -39.08 82.46 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.026 1.73 . . . . 1.0 113.355 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 17.4 tp -85.03 -8.47 58.69 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-O 121.809 0.814 . . . . 1.0 113.128 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 64.41 42.47 5.13 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 128.421 2.688 . . . . 1.0 114.996 174.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.73 154.37 39.64 Favored 'General case' 0 N--CA 1.432 -1.328 0 C-N-CA 127.836 2.454 . . . . 1.0 114.29 176.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -126.76 -175.32 3.37 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.488 -1.301 . . . . 1.0 107.488 -168.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.315 8.6 p-10 -56.51 -26.48 54.72 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 117.014 2.227 . . . . 1.0 117.014 -172.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -137.64 92.46 2.69 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 118.503 0.592 . . . . 1.0 111.682 162.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.72 164.8 11.69 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.833 -1.792 . . . . 1.0 115.119 174.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -126.65 120.08 28.61 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 122.52 1.153 . . . . 1.0 112.52 -173.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mt -105.7 140.73 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 C-N-CA 128.772 2.829 . . . . 1.0 109.078 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -110.92 136.08 50.47 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.305 -1.497 . . . . 1.0 107.97 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 36.5 t -115.17 138.93 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 O-C-N 120.96 -1.088 . . . . 1.0 109.546 -171.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -128.03 140.13 52.14 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-O 122.101 0.953 . . . . 1.0 110.391 172.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -90.24 126.69 35.92 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.269 1.028 . . . . 1.0 111.471 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -86.71 175.3 8.33 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 116.178 1.918 . . . . 1.0 116.178 -167.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.5 tp-100 -137.66 128.19 26.64 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 123.594 0.758 . . . . 1.0 110.863 -178.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.2 t -153.78 150.78 28.84 Favored 'General case' 0 CA--C 1.496 -1.105 0 O-C-N 120.486 -1.384 . . . . 1.0 110.13 174.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -80.51 -4.36 90.1 Favored Glycine 0 N--CA 1.436 -1.329 0 O-C-N 120.536 -1.352 . . . . 1.0 114.69 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.678 0 O-C-N 121.067 -1.255 . . . . 1.0 111.211 175.965 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.84 0 N-CA-C 114.889 0.716 . . . . 1.0 114.889 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 966' ' ' VAL . . . . . 0.658 HG11 HG22 ' A' ' 30' ' ' VAL . 34.2 t -90.48 -108.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 124.579 1.152 . . . . 1.0 109.959 174.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 967' ' ' ILE . . . . . 0.465 HD11 ' HB2' ' A' ' 50' ' ' ARG . 0.9 OUTLIER -90.83 130.61 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 O-C-N 120.881 -1.137 . . . . 1.0 111.37 -155.068 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -102.07 121.9 43.08 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.177 -1.577 . . . . 1.0 111.663 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.03 140.57 40.99 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.734 -1.228 . . . . 1.0 112.704 177.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 41.4 p -127.95 -25.67 3.02 Favored 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 124.286 1.034 . . . . 1.0 112.045 174.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.327 12.9 ttt 17.0 -109.61 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.031 0 C-N-CA 129.941 3.296 . . . . 1.0 119.199 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -147.64 -172.25 3.99 Favored 'General case' 0 N--CA 1.433 -1.323 0 N-CA-C 106.875 -1.528 . . . . 1.0 106.875 -172.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 69.07 16.07 8.69 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 117.652 2.464 . . . . 1.0 117.652 171.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 40.45 -125.09 0.45 Allowed 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 125.758 1.623 . . . . 1.0 113.692 -167.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 975' ' ' GLU . . . . . 0.403 ' H ' ' HG3' ' B' ' 975' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.426 -1.664 0 C-N-CA 127.549 2.34 . . . . 1.0 116.662 175.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.3 ptt? . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 114.294 1.22 . . . . 1.0 114.294 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.26 91.52 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 115.113 1.523 . . . . 1.0 115.113 -174.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -61.17 -28.74 69.35 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 115.253 1.575 . . . . 1.0 115.253 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.51 -39.17 91.52 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 124.721 1.208 . . . . 1.0 113.775 173.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -67.55 144.17 97.54 Favored Pre-proline 0 N--CA 1.435 -1.222 0 N-CA-C 114.997 1.48 . . . . 1.0 114.997 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.11 146.84 4.09 Favored 'Trans proline' 0 N--CA 1.443 -1.461 0 C-N-CA 125.121 3.881 . . . . 1.0 117.851 169.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -84.03 -15.01 49.15 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.904 -1.123 . . . . 1.0 113.828 -169.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -113.43 11.92 18.59 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.339 1.456 . . . . 1.0 111.386 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 77.37 169.99 33.31 Favored Glycine 0 N--CA 1.436 -1.327 0 O-C-N 120.503 -1.373 . . . . 1.0 116.522 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.6 p -126.36 130.56 71.92 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 124.666 1.186 . . . . 1.0 110.892 -172.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt 59.12 37.84 23.99 Favored 'General case' 0 N--CA 1.435 -1.182 0 C-N-CA 126.852 2.061 . . . . 1.0 114.198 -176.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 45.2 p -115.79 23.76 12.04 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 125.634 1.573 . . . . 1.0 110.378 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -91.22 -4.53 55.92 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 120.372 -1.455 . . . . 1.0 112.561 -169.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.0 m120 55.79 -169.57 0.08 Allowed 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 127.904 2.482 . . . . 1.0 114.888 -175.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -120.72 14.16 11.69 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.099 -1.626 . . . . 1.0 114.383 -166.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -90.04 96.11 10.52 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 119.936 -1.728 . . . . 1.0 111.55 -169.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -73.92 135.27 43.26 Favored 'General case' 0 N--CA 1.435 -1.189 0 N-CA-C 115.123 1.527 . . . . 1.0 115.123 -179.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.404 ' HB ' ' HA ' ' A' ' 80' ' ' ASP . 19.9 pt -134.54 160.7 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 C-N-CA 129.489 3.115 . . . . 1.0 105.045 174.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -117.8 144.74 45.08 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 119.286 -2.134 . . . . 1.0 109.717 175.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.97 157.51 43.89 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 119.531 -1.98 . . . . 1.0 108.495 166.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -119.02 150.62 39.65 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-O 122.795 1.283 . . . . 1.0 113.274 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.32 133.08 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 107.567 -1.272 . . . . 1.0 107.567 173.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -142.82 140.57 31.36 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.796 1.284 . . . . 1.0 114.371 -163.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 150.89 -152.63 24.42 Favored Glycine 0 CA--C 1.493 -1.32 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.739 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.2 mm100 53.77 48.3 21.73 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 116.57 2.063 . . . . 1.0 116.57 171.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 70.68 38.61 1.23 Allowed 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 127.951 2.501 . . . . 1.0 111.715 178.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.03 26.59 25.93 Favored Glycine 0 N--CA 1.435 -1.42 0 O-C-N 121.194 -0.941 . . . . 1.0 113.95 173.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.0 m -90.59 127.79 36.38 Favored 'General case' 0 CA--C 1.495 -1.148 0 O-C-N 120.912 -1.346 . . . . 1.0 109.721 165.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.4 t -139.91 133.09 35.57 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 N-CA-C 107.82 -1.178 . . . . 1.0 107.82 -178.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.416 HG22 ' CD1' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -129.14 135.02 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 119.681 -1.887 . . . . 1.0 108.535 161.478 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.71 145.04 26.16 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 123.298 1.523 . . . . 1.0 112.785 159.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.66 ' CE2' HD21 ' B' ' 969' ' ' LEU . 0.0 OUTLIER -138.92 140.61 38.39 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.946 -1.096 . . . . 1.0 108.747 -164.634 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.681 ' O ' HD23 ' B' ' 969' ' ' LEU 0.431 31.3 ttpt -113.48 115.29 27.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.896 1.808 . . . . 1.0 111.798 -169.579 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.8 tp -142.68 154.86 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.484 0 CA-C-N 110.935 -2.848 . . . . 1.0 111.799 -153.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.254 9.2 mtpt -86.68 154.7 20.79 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 112.098 -2.319 . . . . 1.0 112.676 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -71.06 -18.05 62.58 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 117.756 2.502 . . . . 1.0 117.756 -151.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -99.65 -49.93 4.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 119.799 -1.813 . . . . 1.0 111.719 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.6 m -34.0 132.24 0.39 Allowed Pre-proline 0 N--CA 1.439 -1.023 0 C-N-CA 131.286 3.834 . . . . 1.0 118.819 -176.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -45.34 152.41 0.77 Allowed 'Trans proline' 0 N--CA 1.443 -1.456 2 N-CA-C 125.464 5.14 . . . . 1.0 125.464 -165.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -71.18 -25.77 62.68 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 157.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . 0.273 80.9 p -57.67 -29.07 64.32 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.73 -1.856 . . . . 1.0 114.089 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -62.16 -42.56 99.38 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.765 1.226 . . . . 1.0 111.075 174.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -42.9 82.82 Favored 'General case' 0 CA--C 1.491 -1.315 0 C-N-CA 127.639 2.376 . . . . 1.0 112.459 176.381 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.7 ttt -56.84 -43.07 80.75 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -65.74 -41.81 91.71 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.897 -1.127 . . . . 1.0 113.274 172.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.8 -38.71 91.76 Favored 'General case' 0 N--CA 1.435 -1.188 0 C-N-CA 124.68 1.192 . . . . 1.0 113.922 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.416 ' CD1' HG22 ' A' ' 30' ' ' VAL . 3.2 t80 -60.22 -43.2 96.2 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.802 2.041 . . . . 1.0 112.036 171.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.5 m -64.41 -43.05 95.62 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.355 -1.465 . . . . 1.0 114.182 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -65.08 -48.2 74.55 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.468 -1.395 . . . . 1.0 114.283 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -75.33 -43.22 51.86 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 115.505 1.669 . . . . 1.0 115.505 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -114.53 8.36 16.4 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 121.084 -1.01 . . . . 1.0 112.049 -163.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.88 3.43 90.53 Favored Glycine 0 CA--C 1.493 -1.288 0 N-CA-C 117.439 1.735 . . . . 1.0 117.439 159.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.55 155.27 40.23 Favored 'General case' 0 N--CA 1.434 -1.236 0 C-N-CA 125.741 1.616 . . . . 1.0 113.386 -174.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.9 m -102.19 124.93 48.64 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 120.378 -1.451 . . . . 1.0 109.144 175.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.2 ptm -60.95 -29.15 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.019 2.229 . . . . 1.0 117.019 -170.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.99 -15.54 60.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.16 -1.588 . . . . 1.0 114.218 176.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -97.32 -9.61 27.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.564 1.546 . . . . 1.0 112.287 -175.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.0 pt -120.88 143.99 31.27 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 C-N-CA 124.248 1.019 . . . . 1.0 109.597 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -135.92 154.92 50.97 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -113.93 148.54 36.66 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.484 -1.385 . . . . 1.0 109.745 -172.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -137.66 159.41 42.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 123.116 1.436 . . . . 1.0 111.927 177.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -133.25 117.42 17.36 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.177 -1.828 . . . . 1.0 107.992 170.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.7 t70 59.29 31.66 21.34 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 127.312 2.245 . . . . 1.0 113.238 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.48 2.7 88.17 Favored Glycine 0 N--CA 1.435 -1.393 0 O-C-N 119.955 -1.716 . . . . 1.0 114.646 -176.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -102.12 137.06 19.37 Favored Pre-proline 0 N--CA 1.435 -1.214 0 O-C-N 120.161 -1.788 . . . . 1.0 110.076 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -49.09 135.28 30.23 Favored 'Trans proline' 0 N--CA 1.442 -1.553 0 C-N-CA 124.547 3.498 . . . . 1.0 117.832 170.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 pt -121.89 142.49 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 108.244 -1.021 . . . . 1.0 108.244 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -97.65 167.61 10.86 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 121.143 -0.973 . . . . 1.0 110.922 -175.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -67.63 -19.92 65.28 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.444 -1.41 . . . . 1.0 112.684 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.6 m -99.43 2.0 44.69 Favored 'General case' 0 N--CA 1.436 -1.175 0 C-N-CA 126.764 2.026 . . . . 1.0 111.687 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -80.6 169.07 18.13 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 119.028 -2.295 . . . . 1.0 112.24 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.0 p -106.7 153.04 40.94 Favored Pre-proline 0 N--CA 1.438 -1.027 0 O-C-N 120.905 -1.122 . . . . 1.0 113.481 -157.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.05 -31.35 92.82 Favored 'Trans proline' 0 N--CA 1.44 -1.625 0 C-N-CA 123.374 2.716 . . . . 1.0 116.582 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.35 -45.83 78.84 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 114.029 1.122 . . . . 1.0 114.029 174.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.02 -41.3 82.36 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 125.661 1.584 . . . . 1.0 112.622 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 27.7 tp -87.19 -4.03 59.09 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 124.269 1.027 . . . . 1.0 111.601 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 56.85 44.42 23.29 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 126.554 1.942 . . . . 1.0 113.396 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 91.0 mtp -65.98 143.29 57.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.98 2.112 . . . . 1.0 115.148 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -157.56 179.58 9.1 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 105.837 -1.912 . . . . 1.0 105.837 -171.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.404 ' HA ' ' HB ' ' A' ' 18' ' ' ILE 0.3 6.7 p-10 -51.3 -26.52 7.58 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 128.511 2.724 . . . . 1.0 118.239 -178.279 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -137.78 67.45 1.42 Allowed 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 125.106 1.362 . . . . 1.0 110.638 173.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -78.38 162.68 26.26 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 119.342 -2.098 . . . . 1.0 114.409 179.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.6 m -135.39 123.64 23.12 Favored 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.36 1.064 . . . . 1.0 111.053 178.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 78.8 mt -108.0 140.54 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 C-N-CA 126.371 1.869 . . . . 1.0 108.841 174.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -110.97 140.12 45.74 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.612 -1.305 . . . . 1.0 108.562 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.6 t -108.53 139.07 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 O-C-N 120.559 -1.338 . . . . 1.0 109.959 -169.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -124.67 142.63 51.25 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 122.468 1.127 . . . . 1.0 110.059 173.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.7 pm0 -81.84 140.22 34.27 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.065 1.346 . . . . 1.0 111.851 -178.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -138.24 141.96 39.92 Favored 'General case' 0 N--CA 1.434 -1.251 0 O-C-N 120.618 -1.301 . . . . 1.0 109.971 -172.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -107.28 159.33 16.44 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 121.127 -0.983 . . . . 1.0 110.741 -178.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 14.7 t -153.41 153.02 31.72 Favored 'General case' 0 N--CA 1.437 -1.097 0 O-C-N 120.905 -1.122 . . . . 1.0 109.059 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -74.17 -171.95 26.12 Favored Glycine 0 CA--C 1.494 -1.241 0 N-CA-C 116.904 1.522 . . . . 1.0 116.904 -171.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.777 0 O-C-N 121.359 -1.083 . . . . 1.0 111.833 178.833 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.932 0 N-CA-C 115.148 0.819 . . . . 1.0 115.148 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 2.1 p -74.82 -39.96 46.07 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.172 0 CA-C-O 122.801 1.286 . . . . 1.0 111.301 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 3.6 mt -113.13 120.32 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 C-N-CA 125.092 1.357 . . . . 1.0 109.719 162.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.0 140.29 36.49 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 105.032 -2.21 . . . . 1.0 105.032 164.195 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 33' ' ' LYS . 4.0 mm? -73.85 137.89 44.05 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 122.668 2.485 . . . . 1.0 116.754 -175.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 20.9 p -120.86 8.85 10.56 Favored 'General case' 0 CA--C 1.497 -1.095 0 C-N-CA 126.239 1.816 . . . . 1.0 112.073 -171.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 34.5 mtm -115.91 13.3 15.98 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.617 -1.302 . . . . 1.0 111.558 -173.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -147.66 -25.93 0.37 Allowed 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 115.63 1.715 . . . . 1.0 115.63 -153.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 53.6 -175.7 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 123.69 1.71 . . . . 1.0 114.714 -159.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -60.51 -43.96 96.52 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 127.433 2.293 . . . . 1.0 113.271 178.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 . . . . . 0 N--CA 1.424 -1.748 0 C-N-CA 130.795 3.638 . . . . 1.0 111.292 175.59 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.8 mtt . . . . . 0 N--CA 1.484 1.261 0 N-CA-C 109.773 -0.454 . . . . 1.0 109.773 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.35 -5.98 55.57 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 119.793 -1.817 . . . . 1.0 112.929 173.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -64.98 -46.15 82.66 Favored 'General case' 0 N--CA 1.433 -1.303 0 C-N-CA 126.228 1.811 . . . . 1.0 113.995 177.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -63.74 150.1 45.28 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 128.331 2.652 . . . . 1.0 117.016 -175.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -65.59 150.22 96.34 Favored Pre-proline 0 N--CA 1.433 -1.284 0 C-N-CA 125.827 1.651 . . . . 1.0 112.522 168.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -46.85 139.4 14.29 Favored 'Trans proline' 0 C--N 1.308 -1.592 0 C-N-CA 124.397 3.398 . . . . 1.0 116.457 158.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -129.85 -9.5 4.43 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 124.267 1.027 . . . . 1.0 112.541 -174.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -86.94 147.32 25.81 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 125.133 1.373 . . . . 1.0 111.839 176.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -75.33 -166.05 17.74 Favored Glycine 0 N--CA 1.437 -1.28 0 O-C-N 120.603 -1.311 . . . . 1.0 116.119 173.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.312 2.5 t 62.17 62.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.063 0 C-N-CA 126.252 1.821 . . . . 1.0 115.912 172.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -66.31 151.84 46.23 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.508 -1.37 . . . . 1.0 114.336 173.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 57.7 p -75.91 -11.04 59.89 Favored 'General case' 0 CA--C 1.496 -1.111 0 N-CA-C 116.793 2.145 . . . . 1.0 116.793 -166.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -66.47 -35.64 80.78 Favored 'General case' 0 N--CA 1.438 -1.074 0 O-C-N 120.737 -1.227 . . . . 1.0 111.771 169.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.3 t30 71.72 41.06 0.73 Allowed 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 127.164 2.186 . . . . 1.0 112.976 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -130.87 141.16 50.29 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 122.371 1.081 . . . . 1.0 110.063 -174.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.91 10.66 22.97 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 125.398 1.479 . . . . 1.0 113.872 -173.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -78.19 126.18 30.43 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 116.005 1.854 . . . . 1.0 116.005 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.9 pt -143.04 160.75 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 C-N-CA 128.368 2.667 . . . . 1.0 107.545 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -117.66 144.85 44.83 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.143 -2.223 . . . . 1.0 108.422 174.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.692 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -127.19 150.56 49.47 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 119.835 -1.791 . . . . 1.0 107.541 173.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.9 ptpt -115.31 148.94 38.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 119.667 -1.895 . . . . 1.0 110.883 171.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.4 t -119.45 123.52 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.54 -1.652 . . . . 1.0 106.54 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.03 130.1 53.64 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.639 1.209 . . . . 1.0 112.188 -173.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -88.78 -179.69 46.03 Favored Glycine 0 N--CA 1.432 -1.572 0 CA-C-O 122.928 1.293 . . . . 1.0 113.561 177.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -91.9 2.79 56.3 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 121.302 -1.116 . . . . 1.0 112.967 -175.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -97.55 5.66 49.22 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 126.004 1.722 . . . . 1.0 111.373 169.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.17 5.65 89.93 Favored Glycine 0 CA--C 1.494 -1.267 0 O-C-N 120.092 -1.63 . . . . 1.0 114.542 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.6 m -88.7 139.31 30.59 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 124.382 1.073 . . . . 1.0 110.292 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 p -139.88 140.63 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 O-C-N 121.569 -0.707 . . . . 1.0 109.942 -169.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.265 0.6 OUTLIER -129.15 138.76 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 O-C-N 119.888 -1.757 . . . . 1.0 110.571 166.477 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.401 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -118.13 149.21 41.43 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-O 124.199 1.952 . . . . 1.0 113.807 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.44 140.71 37.41 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.724 -1.86 . . . . 1.0 107.771 -162.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -103.88 115.87 31.24 Favored 'General case' 0 CA--C 1.493 -1.232 0 C-N-CA 126.304 1.842 . . . . 1.0 111.697 -175.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.692 HG21 HD22 ' A' ' 20' ' ' LEU . 11.0 tt -143.04 154.77 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.388 0 CA-C-O 124.917 2.294 . . . . 1.0 109.943 -152.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -115.03 153.6 30.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 111.716 -2.493 . . . . 1.0 110.26 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.01 -38.08 89.74 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 115.916 1.821 . . . . 1.0 115.916 -158.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -87.06 10.01 17.91 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.916 -1.115 . . . . 1.0 113.945 175.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.4 m -91.8 121.77 66.53 Favored Pre-proline 0 N--CA 1.437 -1.105 0 O-C-N 119.409 -2.057 . . . . 1.0 108.265 177.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.08 158.2 49.19 Favored 'Trans proline' 0 N--CA 1.441 -1.617 0 C-N-CA 123.13 2.554 . . . . 1.0 115.569 -175.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.448 1.5 pp -63.23 -25.66 68.43 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 115.183 1.549 . . . . 1.0 115.183 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.6 p -52.68 -29.06 24.49 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 120.37 -1.456 . . . . 1.0 114.469 170.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.24 -43.13 71.21 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 119.819 -1.801 . . . . 1.0 112.923 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.09 69.7 Favored 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 120.452 -1.405 . . . . 1.0 113.376 172.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.51 -43.53 98.7 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.433 -1.417 . . . . 1.0 113.289 174.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -42.57 98.6 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.686 -1.259 . . . . 1.0 113.596 170.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.23 86.76 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.21 -43.74 95.71 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 126.005 1.722 . . . . 1.0 111.695 175.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.5 m -62.5 -42.58 99.59 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.86 1.264 . . . . 1.0 114.077 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -64.57 -46.22 83.69 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 120.206 -1.558 . . . . 1.0 114.382 174.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -78.38 -43.2 28.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 116.078 1.881 . . . . 1.0 116.078 -178.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.0 mm100 -113.64 4.98 16.31 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 121.509 -0.744 . . . . 1.0 111.84 -166.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.38 84.1 Favored Glycine 0 CA--C 1.494 -1.251 0 N-CA-C 118.655 2.222 . . . . 1.0 118.655 161.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.5 mt -85.02 164.67 18.11 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 121.187 -1.184 . . . . 1.0 113.841 -172.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.9 m -102.2 135.68 43.37 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.394 -1.441 . . . . 1.0 110.709 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.2 mtp -61.82 -38.71 89.18 Favored 'General case' 0 CA--C 1.495 -1.153 0 C-N-CA 125.887 1.675 . . . . 1.0 114.308 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 ptt-85 -92.67 0.73 57.47 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 125.098 1.359 . . . . 1.0 112.751 -175.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mm-40 -92.73 -24.52 18.56 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.61 -1.306 . . . . 1.0 111.002 175.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.1 pt -120.35 149.34 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 O-C-N 120.972 -1.08 . . . . 1.0 110.82 -174.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -134.41 154.97 51.09 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 107.872 -1.159 . . . . 1.0 107.872 168.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -106.51 148.6 28.02 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 -175.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -142.26 155.36 45.23 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 114.834 1.42 . . . . 1.0 114.834 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -115.19 107.45 15.31 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 106.948 -1.501 . . . . 1.0 106.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.2 t70 52.71 33.32 13.66 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 114.84 1.422 . . . . 1.0 114.84 175.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.49 5.78 89.16 Favored Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 118.755 2.262 . . . . 1.0 118.755 -177.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -123.63 152.83 66.0 Favored Pre-proline 0 N--CA 1.436 -1.145 0 CA-C-O 111.748 -3.977 . . . . 1.0 103.887 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.786 57.9 Cg_exo 71.97 155.76 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.827 2 C-N-CA 111.555 -5.163 . . . . 1.0 116.871 169.535 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.295 5.9 pt -123.91 159.24 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 1 C-N-CA 135.01 5.324 . . . . 1.0 111.136 17.769 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -102.82 163.02 12.46 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 120.816 1.644 . . . . 1.0 110.62 172.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.98 -34.63 75.08 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 119.102 -2.248 . . . . 1.0 115.257 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.4 m -92.03 8.53 37.28 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.5 1.12 . . . . 1.0 111.882 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -81.8 172.74 13.0 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.302 -2.124 . . . . 1.0 108.88 163.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 47.7 p -147.03 159.69 42.17 Favored Pre-proline 0 CA--C 1.498 -1.056 0 O-C-N 119.186 -2.196 . . . . 1.0 111.985 -163.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -59.4 -32.17 96.07 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.602 2.868 . . . . 1.0 115.674 168.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.38 -46.08 81.52 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 119.293 0.951 . . . . 1.0 113.154 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -69.22 -41.39 77.1 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 125.507 1.523 . . . . 1.0 113.605 -177.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -79.94 -8.41 59.31 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.661 -1.275 . . . . 1.0 112.805 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.12 46.87 7.72 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 126.124 1.77 . . . . 1.0 113.753 -178.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.0 mtt -62.26 153.78 29.64 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 126.767 2.027 . . . . 1.0 114.047 173.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.59 -179.9 3.93 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.172 0.989 . . . . 1.0 109.277 -171.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -57.3 -26.6 61.13 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 127.155 2.182 . . . . 1.0 116.007 -175.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -136.54 91.37 2.65 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 107.785 -1.191 . . . . 1.0 107.785 161.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.42 161.43 19.43 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.97 -1.706 . . . . 1.0 112.418 173.424 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.3 m -130.17 115.3 16.82 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 122.224 1.012 . . . . 1.0 110.742 -177.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 140.68 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 126.841 2.056 . . . . 1.0 108.363 -172.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -110.97 151.35 28.04 Favored 'General case' 0 N--CA 1.433 -1.279 0 O-C-N 120.008 -1.682 . . . . 1.0 110.272 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.0 t -108.66 139.56 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 O-C-N 121.026 -1.046 . . . . 1.0 110.29 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -132.43 139.78 48.16 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-O 122.102 0.953 . . . . 1.0 110.036 165.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -87.85 141.21 28.77 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 124.476 1.11 . . . . 1.0 111.482 -175.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -101.0 -141.66 0.34 Allowed 'General case' 0 N--CA 1.434 -1.242 0 C-N-CA 124.641 1.176 . . . . 1.0 113.101 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -65.36 114.01 4.49 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 115.225 1.565 . . . . 1.0 115.225 -174.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 60.4 p -80.5 154.03 27.8 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.616 -1.302 . . . . 1.0 112.683 175.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.94 27.44 28.76 Favored Glycine 0 CA--C 1.493 -1.307 0 O-C-N 120.903 -1.123 . . . . 1.0 113.832 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.71 0 O-C-N 121.346 -1.091 . . . . 1.0 111.314 -178.625 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.925 0 N-CA-C 115.12 0.808 . . . . 1.0 115.12 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER -74.87 -48.28 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 N-CA-C 114.728 1.381 . . . . 1.0 114.728 -168.741 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -107.82 120.13 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.21 0 N-CA-C 107.094 -1.447 . . . . 1.0 107.094 -172.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -102.17 116.9 33.63 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.204 -1.56 . . . . 1.0 107.14 164.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.11 149.82 28.0 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 120.346 1.43 . . . . 1.0 114.851 -175.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 11.0 t -123.05 136.93 55.03 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 124.777 1.231 . . . . 1.0 110.14 175.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 21.2 ttt -155.66 24.07 0.39 Allowed 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.593 1.557 . . . . 1.0 106.889 172.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -144.95 -94.07 0.1 Allowed 'General case' 0 N--CA 1.433 -1.316 0 O-C-N 120.591 -1.318 . . . . 1.0 110.09 -157.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -153.04 26.51 0.54 Allowed 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 125.143 1.377 . . . . 1.0 108.543 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.19 44.07 2.66 Favored 'General case' 0 N--CA 1.435 -1.219 0 C-N-CA 127.09 2.156 . . . . 1.0 115.846 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 . . . . . 0 C--O 1.262 1.727 0 C-N-CA 124.193 0.997 . . . . 1.0 113.626 171.998 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 tpt . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 110.366 -0.235 . . . . 1.0 110.366 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.16 -15.37 60.58 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 119.38 -2.075 . . . . 1.0 113.408 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.15 2.32 56.66 Favored 'General case' 0 N--CA 1.432 -1.328 0 C-N-CA 128.118 2.567 . . . . 1.0 113.621 -174.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 57.03 170.3 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 117.684 2.476 . . . . 1.0 117.684 -176.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.8 mppt? -65.88 153.91 90.33 Favored Pre-proline 0 N--CA 1.435 -1.215 0 C-N-CA 126.299 1.839 . . . . 1.0 112.389 -179.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_exo -44.34 131.93 9.24 Favored 'Trans proline' 0 N--CA 1.442 -1.513 0 C-N-CA 124.793 3.662 . . . . 1.0 117.093 173.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -66.57 131.11 45.31 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 113.904 1.076 . . . . 1.0 113.904 -174.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -79.38 -52.61 7.86 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 120.933 -1.104 . . . . 1.0 112.9 -171.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 59.74 29.09 66.6 Favored Glycine 0 N--CA 1.436 -1.339 0 N-CA-C 119.065 2.386 . . . . 1.0 119.065 165.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.1 p -119.07 138.92 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-N 119.78 1.79 . . . . 1.0 110.058 -176.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -58.92 140.69 55.18 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 120.188 -1.57 . . . . 1.0 113.926 171.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.3 p -115.1 -1.24 13.07 Favored 'General case' 0 N--CA 1.436 -1.128 0 O-C-N 120.704 -1.247 . . . . 1.0 111.761 -176.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 58.56 52.68 6.75 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 115.917 1.821 . . . . 1.0 115.917 170.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.6 m120 -114.42 13.8 17.76 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.597 -1.315 . . . . 1.0 113.354 -171.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 56.98 55.45 6.1 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 125.472 1.509 . . . . 1.0 114.377 178.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -96.67 2.15 51.81 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 117.049 2.24 . . . . 1.0 117.049 -153.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -61.1 138.98 58.19 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.7 pt -135.25 160.65 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 131.213 3.805 . . . . 1.0 106.847 -175.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -113.86 144.9 42.26 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 118.818 -2.426 . . . . 1.0 110.832 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.33 157.62 46.36 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.476 -2.64 . . . . 1.0 105.687 175.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -119.99 150.66 40.17 Favored 'General case' 0 N--CA 1.434 -1.226 0 C-N-CA 127.32 2.248 . . . . 1.0 112.654 171.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.83 132.37 54.32 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.188 0 N-CA-C 106.242 -1.762 . . . . 1.0 106.242 169.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.66 130.15 56.18 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 121.467 0.651 . . . . 1.0 109.479 169.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.49 -179.78 34.98 Favored Glycine 0 N--CA 1.435 -1.372 0 C-N-CA 124.774 1.178 . . . . 1.0 114.69 -176.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -62.58 -38.69 91.11 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 126.565 1.946 . . . . 1.0 114.028 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -75.76 -13.47 60.3 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.348 -1.47 . . . . 1.0 111.905 -178.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.75 1.31 55.22 Favored Glycine 0 N--CA 1.435 -1.406 0 C-N-CA 125.643 1.592 . . . . 1.0 112.899 -176.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.8 m -70.23 146.45 50.67 Favored 'General case' 0 N--CA 1.435 -1.214 0 C-N-CA 125.1 1.36 . . . . 1.0 112.123 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.85 134.86 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 C-N-CA 123.918 0.887 . . . . 1.0 111.398 -172.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.824 HG22 HG11 ' B' ' 966' ' ' VAL . 0.6 OUTLIER -129.14 138.71 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.243 -1.536 . . . . 1.0 107.852 168.279 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.528 ' H ' HG21 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -114.8 158.06 22.4 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 126.538 3.066 . . . . 1.0 113.49 172.504 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.474 ' CE1' ' CG1' ' A' ' 30' ' ' VAL 0.271 25.6 m-85 -145.11 148.23 33.41 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 118.218 -2.801 . . . . 1.0 109.214 -159.575 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -116.51 115.7 26.26 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 120.496 1.498 . . . . 1.0 112.965 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 20.9 tt -150.9 154.75 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 125.665 2.65 . . . . 1.0 111.538 -164.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.69 163.01 13.71 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 110.983 -2.826 . . . . 1.0 111.731 -172.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -69.94 -37.11 75.78 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 117.582 2.438 . . . . 1.0 117.582 -162.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -88.44 -24.32 23.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.401 -1.437 . . . . 1.0 113.174 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m -60.68 137.08 92.94 Favored Pre-proline 0 N--CA 1.438 -1.073 0 C-N-CA 126.544 1.938 . . . . 1.0 114.037 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -76.54 157.2 36.38 Favored 'Trans proline' 0 N--CA 1.441 -1.568 0 CA-C-N 123.76 2.378 . . . . 1.0 115.235 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.319 1.4 pp -62.84 -25.71 68.4 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 125.341 1.456 . . . . 1.0 114.643 179.055 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.0 t -52.8 -29.08 25.57 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.663 -1.898 . . . . 1.0 115.216 170.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HG3' HD12 ' B' ' 969' ' ' LEU . 0.1 OUTLIER -70.12 -45.58 66.57 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.01 -1.681 . . . . 1.0 111.039 -170.34 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.484 HD13 ' H ' ' A' ' 43' ' ' LEU 0.332 0.0 OUTLIER -65.81 -36.5 83.67 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 115.151 1.537 . . . . 1.0 115.151 171.465 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.1 tpp -62.27 -40.66 96.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 114.738 1.385 . . . . 1.0 114.738 177.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -65.7 -41.11 92.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 O-C-N 120.054 -1.654 . . . . 1.0 112.793 171.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.89 -37.14 83.48 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.697 -1.252 . . . . 1.0 114.078 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.39 -44.94 89.16 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.189 -1.569 . . . . 1.0 112.427 171.033 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.6 m -61.75 -39.96 93.45 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 124.126 0.97 . . . . 1.0 113.184 175.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -66.29 -47.82 72.37 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.5 1.12 . . . . 1.0 113.86 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -69.03 -43.32 74.96 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.383 -1.448 . . . . 1.0 114.621 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.2 mm100 -114.19 8.47 16.87 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 114.302 1.223 . . . . 1.0 114.302 -163.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.03 42.23 12.68 Favored Glycine 0 CA--C 1.494 -1.264 0 N-CA-C 116.355 1.302 . . . . 1.0 116.355 163.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 30.5 mt -116.63 162.87 16.97 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 121.176 -1.191 . . . . 1.0 110.165 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 55.0 m -102.36 132.55 48.27 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.535 -1.353 . . . . 1.0 110.019 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.8 tpt -61.78 -40.67 96.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 126.145 1.778 . . . . 1.0 114.229 -166.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -97.62 13.21 30.93 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.708 -1.245 . . . . 1.0 112.131 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -105.93 -7.51 18.14 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 124.22 1.008 . . . . 1.0 111.34 171.024 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.4 pt -111.76 136.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 O-C-N 121.095 -1.003 . . . . 1.0 110.015 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.1 mmt180 -123.79 139.03 54.38 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.709 -1.244 . . . . 1.0 109.54 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.432 ' HB2' HD11 ' A' ' 67' ' ' ILE . 0.1 OUTLIER -120.27 143.94 48.05 Favored 'General case' 0 N--CA 1.433 -1.323 0 O-C-N 120.675 -1.266 . . . . 1.0 111.48 -162.402 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -141.11 154.79 46.08 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 124.508 1.123 . . . . 1.0 110.445 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -133.62 117.92 17.61 Favored 'General case' 0 N--CA 1.433 -1.305 0 O-C-N 120.626 -1.296 . . . . 1.0 108.351 176.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 44.2 t0 51.62 45.05 28.7 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.117 1.767 . . . . 1.0 112.713 -175.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.2 0.96 72.78 Favored Glycine 0 N--CA 1.436 -1.349 0 N-CA-C 116.58 1.392 . . . . 1.0 116.58 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -112.64 128.92 24.94 Favored Pre-proline 0 N--CA 1.436 -1.125 0 O-C-N 120.027 -1.867 . . . . 1.0 110.728 -174.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -48.53 136.19 26.56 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 124.686 3.591 . . . . 1.0 117.952 170.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.432 HD11 ' HB2' ' A' ' 60' ' ' PHE . 4.3 pt -123.19 154.18 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.183 0 C-N-CA 125.36 1.464 . . . . 1.0 109.349 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -110.49 161.2 15.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 121.036 -1.04 . . . . 1.0 109.049 -171.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -65.88 -25.6 67.25 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 119.536 -1.978 . . . . 1.0 113.243 173.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 m -78.42 -18.4 55.03 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.531 1.932 . . . . 1.0 112.947 173.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -67.52 160.26 28.01 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-O 124.189 1.947 . . . . 1.0 112.495 174.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.3 p -144.31 162.22 40.85 Favored Pre-proline 0 CA--C 1.496 -1.133 0 CA-C-N 114.472 -1.24 . . . . 1.0 110.025 -158.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -60.56 -32.44 93.5 Favored 'Trans proline' 0 N--CA 1.439 -1.698 0 C-N-CA 123.2 2.6 . . . . 1.0 114.558 168.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.22 -45.73 83.52 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 122.264 1.03 . . . . 1.0 113.155 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -71.22 -44.36 65.53 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 124.735 1.214 . . . . 1.0 113.2 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -87.75 -8.35 56.14 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 113.568 0.951 . . . . 1.0 113.568 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.29 42.24 15.29 Favored 'General case' 0 N--CA 1.435 -1.214 0 C-N-CA 128.664 2.786 . . . . 1.0 115.901 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtm -69.61 154.24 42.29 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 126.861 2.065 . . . . 1.0 113.832 169.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -141.02 -175.09 4.18 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 105.919 -1.882 . . . . 1.0 105.919 -164.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.337 4.0 p-10 -50.45 -26.47 5.11 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 118.875 2.917 . . . . 1.0 118.875 -167.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -141.48 58.54 1.51 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.34 1.056 . . . . 1.0 113.062 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 169.35 16.87 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 119.005 -2.31 . . . . 1.0 116.821 -173.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.3 m -131.87 122.12 25.17 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 124.998 1.319 . . . . 1.0 112.182 -176.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 52.8 mt -112.91 140.73 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.061 0 C-N-CA 127.65 2.38 . . . . 1.0 108.132 175.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -110.95 134.28 52.7 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 120.66 -1.275 . . . . 1.0 108.615 -177.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.69 132.96 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 C-N-CA 125.328 1.451 . . . . 1.0 107.139 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -130.52 134.23 46.88 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.732 1.253 . . . . 1.0 110.956 177.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -88.05 140.25 29.68 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 124.988 1.315 . . . . 1.0 112.968 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -116.16 -168.02 1.37 Allowed 'General case' 0 N--CA 1.434 -1.238 0 C-N-CA 126.017 1.727 . . . . 1.0 112.162 -172.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.8 mp0 -62.49 146.53 51.4 Favored 'General case' 0 N--CA 1.436 -1.173 0 C-N-CA 125.779 1.632 . . . . 1.0 114.281 177.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 77.2 p -71.17 -42.97 68.38 Favored 'General case' 0 CA--C 1.496 -1.121 0 O-C-N 120.807 -1.183 . . . . 1.0 113.676 176.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.76 151.85 52.44 Favored Glycine 0 CA--C 1.493 -1.331 0 O-C-N 120.493 -1.379 . . . . 1.0 114.614 176.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.712 0 N-CA-C 109.671 -1.372 . . . . 1.0 109.671 -177.833 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.938 0 CA-C-O 120.146 -0.252 . . . . 1.0 113.114 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 966' ' ' VAL . . . . . 0.824 HG11 HG22 ' A' ' 30' ' ' VAL . 2.2 t -77.31 -125.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 CA-C-N 118.771 1.285 . . . . 1.0 113.391 173.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -109.56 125.19 66.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 O-C-N 118.962 -2.337 . . . . 1.0 112.763 -146.664 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -99.37 125.05 44.98 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.12 2.168 . . . . 1.0 110.382 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.508 HD12 ' HG3' ' A' ' 42' ' ' LYS . 2.0 mm? -108.13 145.65 33.82 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 116.165 1.913 . . . . 1.0 116.165 -173.023 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 72.6 p -130.97 -144.69 0.26 Allowed 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 126.642 1.977 . . . . 1.0 108.785 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.364 21.0 ttp 88.46 29.96 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 126.895 2.078 . . . . 1.0 115.678 167.267 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -137.49 -82.3 0.35 Allowed 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 104.27 -2.493 . . . . 1.0 104.27 167.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -110.93 177.6 4.61 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 102.704 -3.073 . . . . 1.0 102.704 147.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -65.54 -52.09 55.06 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 120.732 -1.23 . . . . 1.0 111.859 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.293 30.9 tt0 . . . . . 0 C--O 1.259 1.563 0 N-CA-C 116.221 1.934 . . . . 1.0 116.221 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.7 mmm . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 111.399 0.148 . . . . 1.0 111.399 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.67 -41.12 96.31 Favored 'General case' 0 N--CA 1.435 -1.204 0 N-CA-C 115.94 1.829 . . . . 1.0 115.94 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -61.26 -37.26 82.48 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 116.791 2.145 . . . . 1.0 116.791 -168.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -54.99 137.04 47.06 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 115.813 1.782 . . . . 1.0 115.813 -177.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -93.75 158.87 35.81 Favored Pre-proline 0 N--CA 1.434 -1.253 0 C-N-CA 126.509 1.924 . . . . 1.0 111.33 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -43.75 149.65 0.67 Allowed 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 124.639 3.559 . . . . 1.0 117.101 163.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.0 pttm -128.05 -7.19 5.45 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 118.973 0.806 . . . . 1.0 112.069 178.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -117.2 132.05 56.73 Favored 'General case' 0 N--CA 1.434 -1.253 0 O-C-N 120.567 -1.333 . . . . 1.0 111.009 -172.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 80.07 13.51 81.95 Favored Glycine 0 N--CA 1.437 -1.252 0 O-C-N 120.523 -1.36 . . . . 1.0 114.393 -171.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -96.0 138.31 21.78 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.127 0 O-C-N 120.756 -1.438 . . . . 1.0 110.717 -170.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -125.16 148.25 48.67 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.758 -1.214 . . . . 1.0 108.834 169.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.9 t -156.01 -6.28 0.12 Allowed 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 116.074 1.879 . . . . 1.0 116.074 173.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -125.13 -35.53 2.63 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.148 -1.595 . . . . 1.0 111.014 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -142.12 158.68 43.47 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 120.765 -1.209 . . . . 1.0 110.215 -177.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -45.31 158.35 0.07 Allowed 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 117.702 2.482 . . . . 1.0 117.702 173.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -96.81 39.89 1.16 Allowed 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 124.85 1.26 . . . . 1.0 114.367 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -71.85 139.98 49.14 Favored 'General case' 0 CA--C 1.497 -1.058 0 O-C-N 119.065 -2.272 . . . . 1.0 115.85 176.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.6 pt -140.35 160.76 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 128.568 2.747 . . . . 1.0 105.832 175.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -109.44 144.75 37.24 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 118.838 -2.414 . . . . 1.0 107.995 168.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -137.38 147.76 45.72 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.613 -1.93 . . . . 1.0 106.988 175.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -116.83 150.59 38.12 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 125.6 1.56 . . . . 1.0 113.022 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.453 HG23 HD11 ' A' ' 43' ' ' LEU . 9.9 t -111.78 125.98 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.206 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 170.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.34 134.48 54.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 122.406 1.098 . . . . 1.0 112.593 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.7 -156.85 19.92 Favored Glycine 0 CA--C 1.492 -1.398 0 O-C-N 120.744 -1.222 . . . . 1.0 111.319 177.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 55.11 40.45 31.85 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 116.638 2.088 . . . . 1.0 116.638 164.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 t70 66.96 43.09 2.28 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 126.255 1.822 . . . . 1.0 112.784 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.51 24.82 25.08 Favored Glycine 0 N--CA 1.436 -1.309 0 O-C-N 120.798 -1.189 . . . . 1.0 115.213 174.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -101.26 127.95 47.62 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-O 122.669 1.223 . . . . 1.0 110.064 173.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.4 t -139.87 137.63 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 O-C-N 120.669 -1.27 . . . . 1.0 109.195 -166.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.18 138.73 53.69 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 O-C-N 120.236 -1.54 . . . . 1.0 110.383 169.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.12 145.05 50.12 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 123.183 1.468 . . . . 1.0 112.696 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.621 ' CD2' HG21 ' B' ' 967' ' ' ILE 0.342 0.5 OUTLIER -144.41 140.61 29.11 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.118 -1.614 . . . . 1.0 108.627 -158.274 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.323 35.6 ttpt -110.96 115.5 29.59 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 123.428 1.585 . . . . 1.0 112.037 -170.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.72 HD11 HG21 ' A' ' 38' ' ' THR . 4.6 tp -154.81 154.83 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 127.498 3.523 . . . . 1.0 112.624 -163.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.706 ' H ' HD12 ' A' ' 34' ' ' ILE . 11.4 mptt -64.12 142.88 58.25 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 109.414 -3.539 . . . . 1.0 113.685 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.9 ttt-85 -71.2 -28.48 64.25 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.168 -1.378 . . . . 1.0 113.516 -173.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -76.21 -29.84 57.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 115.648 1.721 . . . . 1.0 115.648 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.72 HG21 HD11 ' A' ' 34' ' ' ILE . 75.0 m -62.49 141.26 96.68 Favored Pre-proline 0 N--CA 1.439 -1.004 0 C-N-CA 127.425 2.29 . . . . 1.0 114.288 -175.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -56.27 145.93 74.89 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 123.957 3.104 . . . . 1.0 116.797 174.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.426 HD21 ' O ' ' A' ' 68' ' ' ASN 0.291 1.3 pt? -63.74 -25.61 68.27 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 114.498 1.296 . . . . 1.0 114.498 172.108 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.8 t -52.64 -29.13 24.58 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 125.787 1.635 . . . . 1.0 114.62 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -65.77 -42.47 90.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.314 -2.116 . . . . 1.0 112.553 176.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.453 HD11 HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -62.87 -41.58 99.44 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 126.441 1.896 . . . . 1.0 114.463 171.411 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 77.0 mtp -57.31 -45.9 83.75 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 113.578 0.955 . . . . 1.0 113.578 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -66.35 -40.2 89.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.456 -1.403 . . . . 1.0 113.044 173.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.34 83.41 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.563 -1.336 . . . . 1.0 114.054 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -61.58 -42.28 98.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 O-C-N 120.21 -1.556 . . . . 1.0 110.83 172.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.8 m -61.35 -46.34 90.65 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.135 1.532 . . . . 1.0 115.135 173.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -69.55 -49.85 50.47 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 115.873 1.805 . . . . 1.0 115.873 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -70.63 -38.18 73.88 Favored 'General case' 0 CA--C 1.493 -1.236 0 C-N-CA 125.632 1.573 . . . . 1.0 113.877 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.96 10.95 20.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 O-C-N 121.509 -0.745 . . . . 1.0 111.676 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.81 44.75 24.06 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.756 1.462 . . . . 1.0 116.756 161.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.2 mt -121.66 154.47 36.79 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 121.469 -1.019 . . . . 1.0 110.957 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.0 m -100.14 136.27 40.29 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 120.514 -1.366 . . . . 1.0 109.923 174.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.4 tpt -59.55 -35.05 73.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.86 2.064 . . . . 1.0 114.055 -176.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ptt-85 -90.0 4.15 51.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.203 1.801 . . . . 1.0 111.151 -174.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.02 -14.49 16.44 Favored 'General case' 0 N--CA 1.432 -1.367 0 O-C-N 121.024 -1.047 . . . . 1.0 111.854 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.6 pt -127.76 159.97 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 119.897 1.226 . . . . 1.0 112.282 -166.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -138.31 147.71 43.85 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.201 -1.037 . . . . 1.0 108.201 169.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.458 ' HB3' HD11 ' A' ' 67' ' ' ILE . 63.5 m-85 -104.6 144.57 31.52 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 126.455 1.902 . . . . 1.0 107.438 -172.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.687 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 7.5 tmm_? -152.19 144.81 24.21 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 -167.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.687 ' CG ' ' HA ' ' A' ' 61' ' ' ARG 0.804 0.0 OUTLIER -123.1 142.63 50.67 Favored 'General case' 0 N--CA 1.408 -2.566 1 N-CA-C 94.606 -6.072 . . . . 1.0 94.606 -122.145 . . . . . . . . 5 4 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -69.83 74.68 0.44 Allowed 'General case' 0 N--CA 1.438 -1.038 0 O-C-N 119.747 -1.845 . . . . 1.0 115.434 -159.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.42 3.93 78.73 Favored Glycine 0 N--CA 1.433 -1.518 0 C-N-CA 127.639 2.542 . . . . 1.0 112.251 -159.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.632 ' O ' ' HB2' ' A' ' 62' ' ' PHE . 53.4 mt-30 -123.75 153.22 66.77 Favored Pre-proline 0 N--CA 1.428 -1.532 1 N-CA-C 99.719 -4.178 . . . . 1.0 99.719 -158.3 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.65 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 55.5 Cg_endo -72.12 135.97 26.1 Favored 'Trans proline' 0 N--CA 1.444 -1.406 1 C-N-CA 125.457 4.105 . . . . 1.0 116.295 148.22 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.567 HG12 ' HB3' ' A' ' 62' ' ' PHE . 5.8 pt -117.59 127.24 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.117 0 C-N-CA 126.897 2.079 . . . . 1.0 108.976 171.378 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.426 ' O ' HD21 ' A' ' 40' ' ' LEU . 39.4 m-80 -112.8 158.75 19.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 125.381 1.473 . . . . 1.0 108.772 175.443 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -59.99 -25.32 65.15 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 118.9 -2.375 . . . . 1.0 116.947 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 m -92.35 -2.27 56.49 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.622 -1.299 . . . . 1.0 111.351 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -73.18 171.81 12.28 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 119.311 -2.118 . . . . 1.0 111.988 172.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 64.9 p -146.34 154.41 49.37 Favored Pre-proline 0 CA--C 1.495 -1.141 0 O-C-N 120.097 -1.627 . . . . 1.0 109.415 -162.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.404 ' HB3' ' HB2' ' A' ' 78' ' ' MET . 39.7 Cg_exo -58.16 -31.64 93.8 Favored 'Trans proline' 0 N--CA 1.44 -1.672 0 C-N-CA 123.272 2.648 . . . . 1.0 116.078 170.127 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.09 89.99 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -74.35 -41.11 61.59 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.966 1.306 . . . . 1.0 113.306 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.78 -8.49 59.7 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 122.124 0.964 . . . . 1.0 112.665 178.017 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.289 42.2 mm-40 64.43 48.16 2.82 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 126.204 1.802 . . . . 1.0 114.416 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.404 ' HB2' ' HB3' ' A' ' 73' ' ' PRO . 66.2 mtt -82.05 154.25 25.72 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 127.03 2.132 . . . . 1.0 111.06 172.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -125.89 -178.98 4.47 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 121.062 -1.024 . . . . 1.0 109.396 -164.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.376 9.1 p-10 -54.1 -26.55 27.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 117.217 2.303 . . . . 1.0 117.217 -174.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -135.75 89.49 2.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 123.277 0.631 . . . . 1.0 111.366 158.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.7 170.53 10.06 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 116.765 2.135 . . . . 1.0 116.765 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.9 m -135.87 120.95 18.84 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 125.008 1.323 . . . . 1.0 112.473 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.8 mt -110.22 140.78 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.106 0 C-N-CA 129.972 3.309 . . . . 1.0 108.31 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -110.82 146.43 36.43 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.939 -1.726 . . . . 1.0 108.693 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.4 t -121.18 139.69 47.59 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.218 0 O-C-N 121.17 -0.956 . . . . 1.0 108.969 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -128.58 143.24 50.92 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 121.367 -0.833 . . . . 1.0 111.14 163.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -87.16 130.27 34.6 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.739 1.257 . . . . 1.0 112.76 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -102.07 -22.69 14.19 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 125.169 1.387 . . . . 1.0 111.147 -179.184 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . 0.318 22.0 pt20 50.94 40.29 24.85 Favored 'General case' 0 N--CA 1.436 -1.13 0 C-N-CA 128.954 2.901 . . . . 1.0 117.853 173.436 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 21.0 p -81.42 -47.07 13.7 Favored 'General case' 0 N--CA 1.436 -1.133 0 O-C-N 120.264 -1.522 . . . . 1.0 112.799 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -86.93 -176.83 49.23 Favored Glycine 0 N--CA 1.436 -1.328 0 O-C-N 120.737 -1.227 . . . . 1.0 112.006 169.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.742 0 O-C-N 121.463 -1.022 . . . . 1.0 110.606 175.338 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.951 0 N-CA-C 114.784 0.674 . . . . 1.0 114.784 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 16.5 t -74.92 -57.91 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.134 0 CA-C-O 123.978 1.847 . . . . 1.0 114.012 -171.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 967' ' ' ILE . . . . . 0.621 HG21 ' CD2' ' A' ' 32' ' ' PHE . 6.5 mt -113.05 111.01 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 C-N-CA 127.127 2.171 . . . . 1.0 110.808 -171.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -102.18 109.08 20.67 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 119.172 -2.205 . . . . 1.0 112.703 171.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.501 ' CD1' HD13 ' A' ' 34' ' ' ILE 0.275 0.4 OUTLIER -102.83 156.05 17.92 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 122.713 2.506 . . . . 1.0 114.433 -172.101 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 69.1 p -111.92 17.11 20.02 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 126.1 1.76 . . . . 1.0 111.316 -170.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 22.7 ttt -57.88 -33.94 69.25 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 116.37 1.989 . . . . 1.0 116.37 -174.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -144.36 145.08 31.75 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 120.88 -1.138 . . . . 1.0 109.817 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 1.1 t70 52.84 -143.96 0.67 Allowed 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 115.595 1.702 . . . . 1.0 115.595 162.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -87.51 132.7 33.94 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 128.131 2.573 . . . . 1.0 109.344 176.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 . . . . . 0 C--O 1.261 1.709 0 N-CA-C 116.667 2.099 . . . . 1.0 116.667 -165.737 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.8 mtp . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 112.308 0.484 . . . . 1.0 112.308 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.18 -42.87 83.51 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.857 -1.152 . . . . 1.0 113.667 178.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -128.88 119.09 23.81 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 126.03 1.732 . . . . 1.0 107.733 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -98.87 -12.74 20.49 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.23 -1.544 . . . . 1.0 113.262 -169.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -64.65 137.99 97.31 Favored Pre-proline 0 N--CA 1.436 -1.163 0 O-C-N 120.318 -1.489 . . . . 1.0 114.445 -178.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.27 142.63 19.19 Favored 'Trans proline' 0 N--CA 1.442 -1.546 0 C-N-CA 122.651 2.234 . . . . 1.0 113.037 -164.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -106.82 -2.2 21.68 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 124.156 0.983 . . . . 1.0 111.604 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -59.9 152.53 23.22 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 117.458 2.392 . . . . 1.0 117.458 178.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -85.28 179.6 50.71 Favored Glycine 0 N--CA 1.437 -1.259 0 O-C-N 120.848 -1.158 . . . . 1.0 111.898 161.467 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.3 p -68.87 142.29 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.105 0 O-C-N 120.705 -1.468 . . . . 1.0 113.991 -178.085 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -111.67 6.45 19.9 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.716 -1.865 . . . . 1.0 112.454 -174.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 62.5 p -112.82 145.29 40.9 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 120.602 -1.311 . . . . 1.0 111.149 -175.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -63.08 -45.9 89.97 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 124.309 1.044 . . . . 1.0 113.362 -175.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -148.87 147.12 28.34 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 107.454 -1.313 . . . . 1.0 107.454 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -64.39 145.47 56.0 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 115.206 1.558 . . . . 1.0 115.206 -173.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -105.49 13.87 29.48 Favored 'General case' 0 N--CA 1.436 -1.148 0 C-N-CA 126.439 1.896 . . . . 1.0 115.12 -178.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.68 151.52 46.34 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 115.511 1.671 . . . . 1.0 115.511 175.288 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -140.66 160.68 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 127.306 2.242 . . . . 1.0 109.158 -172.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -117.72 144.77 44.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 118.87 -2.393 . . . . 1.0 109.127 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -127.91 157.49 40.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 O-C-N 119.136 -2.227 . . . . 1.0 106.159 167.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 14.4 ptpt -109.35 150.6 27.78 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 125.578 1.551 . . . . 1.0 110.539 161.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.417 HG22 ' HB ' ' A' ' 84' ' ' ILE . 39.4 t -116.94 124.93 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 171.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.06 130.13 51.66 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 122.654 1.216 . . . . 1.0 111.837 -176.393 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.404 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -88.3 -177.82 47.2 Favored Glycine 0 N--CA 1.434 -1.472 0 CA-C-O 122.763 1.202 . . . . 1.0 115.727 -176.239 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.11 -25.59 66.28 Favored 'General case' 0 N--CA 1.434 -1.23 0 C-N-CA 125.653 1.581 . . . . 1.0 114.723 -175.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.6 p30 -94.64 1.55 55.58 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 124.662 1.185 . . . . 1.0 111.907 173.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.95 4.85 71.63 Favored Glycine 0 CA--C 1.493 -1.319 0 O-C-N 120.489 -1.382 . . . . 1.0 115.086 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 m -70.25 128.1 35.07 Favored 'General case' 0 CA--C 1.495 -1.151 0 CA-C-N 119.0 1.4 . . . . 1.0 113.206 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -130.51 137.18 56.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-O 122.297 1.046 . . . . 1.0 113.26 -163.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.24 138.81 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.07 0 O-C-N 119.776 -1.827 . . . . 1.0 109.637 160.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -119.96 139.5 52.37 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-O 123.163 1.459 . . . . 1.0 112.309 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.521 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.0 OUTLIER -145.05 142.57 29.84 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.412 -1.43 . . . . 1.0 113.949 -163.061 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.427 ' O ' HD23 ' B' ' 969' ' ' LEU 0.305 14.0 ttpt -109.34 115.71 30.48 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.696 1.236 . . . . 1.0 114.2 -167.246 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 14.0 tt -146.28 154.75 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.461 0 CA-C-O 126.183 2.897 . . . . 1.0 110.012 -152.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.477 ' HE2' ' HA ' ' B' ' 973' ' ' ASP . 8.5 mtpp -107.65 158.07 17.56 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 110.768 -2.923 . . . . 1.0 111.413 -171.584 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -68.96 -37.99 79.14 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 117.275 2.324 . . . . 1.0 117.275 -151.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -87.95 -12.08 45.66 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 120.683 -1.26 . . . . 1.0 113.658 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 94.6 m -60.1 144.28 87.17 Favored Pre-proline 0 N--CA 1.437 -1.077 0 C-N-CA 128.091 2.556 . . . . 1.0 114.315 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -65.66 148.9 87.51 Favored 'Trans proline' 0 N--CA 1.44 -1.647 0 CA-C-N 124.935 2.798 . . . . 1.0 116.04 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.572 ' HA ' HD22 ' A' ' 43' ' ' LEU 0.368 0.6 OUTLIER -64.06 -25.66 68.21 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 115.266 1.58 . . . . 1.0 115.266 169.354 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.1 t -52.49 -29.04 22.94 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 126.917 2.087 . . . . 1.0 112.603 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -67.5 -36.87 81.9 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.431 -1.418 . . . . 1.0 111.822 -178.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.572 HD22 ' HA ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -64.08 -42.25 97.02 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 125.036 1.335 . . . . 1.0 112.144 172.015 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 ttm -58.39 -43.14 88.41 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 113.96 1.096 . . . . 1.0 113.96 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.19 -41.97 94.02 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.258 1.023 . . . . 1.0 112.429 173.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -38.6 90.43 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.525 -1.359 . . . . 1.0 114.459 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.472 ' CE2' HD12 ' A' ' 53' ' ' LEU . 12.5 t80 -60.98 -41.28 96.15 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 126.37 1.868 . . . . 1.0 111.769 173.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.2 m -62.92 -45.11 94.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.802 -1.186 . . . . 1.0 113.987 171.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -64.52 -51.74 61.34 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 119.944 -1.723 . . . . 1.0 114.618 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -76.43 -43.27 40.91 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 115.028 1.492 . . . . 1.0 115.028 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.63 2.25 25.8 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 121.289 -0.882 . . . . 1.0 110.602 -166.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.54 7.94 85.54 Favored Glycine 0 CA--C 1.493 -1.316 0 N-CA-C 117.576 1.79 . . . . 1.0 117.576 164.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.472 HD12 ' CE2' ' A' ' 47' ' ' TYR . 10.1 mt -83.79 166.76 17.72 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 119.165 1.482 . . . . 1.0 113.577 -172.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 67.1 m -102.28 131.47 48.84 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.519 -1.363 . . . . 1.0 112.052 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.5 ptp -66.51 -30.38 70.69 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt85 -75.18 -18.51 60.15 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.187 -1.571 . . . . 1.0 113.54 175.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -93.85 -10.62 33.38 Favored 'General case' 0 N--CA 1.435 -1.216 0 O-C-N 120.874 -1.141 . . . . 1.0 112.812 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.6 pt -114.15 146.5 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 C-N-CA 124.233 1.013 . . . . 1.0 111.204 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -136.93 137.08 39.18 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.731 -1.231 . . . . 1.0 108.479 167.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -103.27 148.62 25.61 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.024 -1.048 . . . . 1.0 111.227 -174.174 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -138.7 162.09 35.54 Favored 'General case' 0 N--CA 1.433 -1.276 0 O-C-N 120.97 -1.081 . . . . 1.0 109.864 174.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -115.33 110.04 18.8 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.561 -0.903 . . . . 1.0 108.561 164.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.5 t0 41.29 55.65 3.28 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.303 2.241 . . . . 1.0 114.738 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 2.32 90.64 Favored Glycine 0 N--CA 1.435 -1.368 0 N-CA-C 117.691 1.836 . . . . 1.0 117.691 -176.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -109.87 119.64 47.01 Favored Pre-proline 0 N--CA 1.435 -1.175 0 CA-C-N 120.954 2.377 . . . . 1.0 110.786 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -46.61 136.98 15.8 Favored 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 124.525 3.483 . . . . 1.0 117.391 165.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 pt -123.26 153.56 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 C-N-CA 125.132 1.373 . . . . 1.0 107.878 177.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -112.6 162.15 16.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.612 -1.305 . . . . 1.0 110.747 -172.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -73.93 -15.25 61.13 Favored 'General case' 0 N--CA 1.436 -1.135 0 O-C-N 119.16 -2.212 . . . . 1.0 115.058 -176.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.8 m -95.16 -3.64 47.52 Favored 'General case' 0 N--CA 1.438 -1.066 0 O-C-N 120.606 -1.309 . . . . 1.0 111.65 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -73.1 169.98 15.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 118.22 -2.8 . . . . 1.0 111.369 169.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 53.2 p -148.32 160.52 36.65 Favored Pre-proline 0 CA--C 1.495 -1.146 0 O-C-N 119.707 -1.871 . . . . 1.0 110.125 -157.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -58.51 -34.52 98.85 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.301 2.667 . . . . 1.0 114.748 167.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.1 -45.99 75.55 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 114.118 1.155 . . . . 1.0 114.118 175.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -70.41 -39.06 74.68 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.115 1.366 . . . . 1.0 114.056 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.6 tp -86.9 -8.49 57.22 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 120.759 -1.213 . . . . 1.0 112.355 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.263 40.7 mt-10 61.97 43.86 8.74 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 126.64 1.976 . . . . 1.0 114.382 177.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.2 mtt -57.23 154.19 10.72 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 128.262 2.625 . . . . 1.0 113.052 167.127 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -116.99 -177.44 3.2 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 120.981 -1.074 . . . . 1.0 108.848 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.373 10.4 p-10 -57.74 -26.6 62.06 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 126.318 1.847 . . . . 1.0 115.636 -178.322 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -139.15 85.94 2.1 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.13 1.772 . . . . 1.0 110.344 166.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.28 165.37 16.5 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 120.432 -1.417 . . . . 1.0 113.807 175.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 69.5 m -132.01 121.37 23.79 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.216 1.406 . . . . 1.0 110.677 172.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.417 ' HB ' HG22 ' A' ' 22' ' ' VAL . 46.2 mm -115.55 140.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 C-N-CA 127.134 2.174 . . . . 1.0 109.315 -178.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -111.16 139.83 46.22 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 120.193 -1.567 . . . . 1.0 111.97 -164.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.404 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 9.9 t -113.15 133.61 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 CA-C-O 122.766 1.27 . . . . 1.0 111.165 -178.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.74 138.11 51.71 Favored 'General case' 0 N--CA 1.433 -1.279 0 CA-C-O 122.554 1.169 . . . . 1.0 110.651 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.7 mm100 -89.43 137.01 32.7 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 124.242 1.017 . . . . 1.0 111.195 -175.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -100.8 164.74 11.71 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 115.219 1.562 . . . . 1.0 115.219 -174.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -124.43 137.16 54.47 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.685 -1.143 . . . . 1.0 111.609 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.7 t -154.03 169.2 24.07 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 120.858 -1.151 . . . . 1.0 109.717 -175.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.93 12.08 84.77 Favored Glycine 0 N--CA 1.437 -1.29 0 O-C-N 119.714 -1.866 . . . . 1.0 116.502 173.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.754 0 O-C-N 121.032 -1.275 . . . . 1.0 110.528 -175.16 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.87 0 N-CA-C 113.503 0.161 . . . . 1.0 113.503 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 11.2 t -75.15 -57.82 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 CA-C-O 123.494 1.616 . . . . 1.0 113.974 -173.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 967' ' ' ILE . . . . . 0.521 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 7.0 mt -113.21 129.09 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 C-N-CA 127.454 2.302 . . . . 1.0 113.298 -165.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -102.08 129.59 48.46 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.292 -1.505 . . . . 1.0 108.174 167.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.427 HD23 ' O ' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -74.0 167.94 20.51 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 117.919 2.563 . . . . 1.0 117.919 -170.308 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 13.7 p -140.36 175.83 9.27 Favored 'General case' 0 N--CA 1.437 -1.075 0 C-N-CA 129.143 2.977 . . . . 1.0 107.684 -175.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 32.8 ttp 72.82 54.39 0.14 Allowed 'General case' 0 N--CA 1.439 -1.008 0 O-C-N 119.597 -1.939 . . . . 1.0 114.515 176.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 27.6 t0 83.48 12.96 0.39 Allowed 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 127.953 2.501 . . . . 1.0 111.726 -176.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 973' ' ' ASP . . . . . 0.477 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 1.1 m-20 -113.11 69.62 0.7 Allowed 'General case' 0 N--CA 1.428 -1.539 0 CA-C-O 122.513 1.149 . . . . 1.0 108.596 174.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -62.89 -43.98 97.34 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 116.33 1.974 . . . . 1.0 116.33 -171.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 . . . . . 0 C--O 1.261 1.68 0 C-N-CA 127.561 2.344 . . . . 1.0 110.823 -179.999 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.483 1.21 0 N-CA-C 113.555 0.946 . . . . 1.0 113.555 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.12 -44.97 94.49 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 115.873 1.805 . . . . 1.0 115.873 -174.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -65.69 -47.13 76.45 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.86 -1.15 . . . . 1.0 113.745 177.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -97.68 -4.57 37.06 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 114.949 1.463 . . . . 1.0 114.949 -166.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -68.34 147.75 98.21 Favored Pre-proline 0 N--CA 1.436 -1.166 0 O-C-N 119.904 -1.747 . . . . 1.0 113.433 169.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -55.72 129.78 36.86 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 124.413 3.408 . . . . 1.0 116.996 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -66.2 147.89 52.65 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 124.717 1.207 . . . . 1.0 113.704 170.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -130.41 130.79 44.78 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 121.13 -0.982 . . . . 1.0 112.863 -165.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.2 21.37 58.94 Favored Glycine 0 N--CA 1.437 -1.241 0 N-CA-C 116.72 1.448 . . . . 1.0 116.72 167.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.5 t -65.58 -42.64 93.42 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 O-C-N 121.034 -1.274 . . . . 1.0 113.911 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -62.32 140.41 58.51 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 115.329 1.603 . . . . 1.0 115.329 176.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.3 t -156.81 156.18 32.8 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 175.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.272 46.6 mt-10 61.88 159.11 0.06 Allowed 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 126.533 1.933 . . . . 1.0 114.739 -162.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.0 m120 54.16 56.72 6.66 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 116.121 1.897 . . . . 1.0 116.121 173.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -148.7 173.7 12.95 Favored 'General case' 0 N--CA 1.434 -1.243 0 O-C-N 120.949 -1.094 . . . . 1.0 110.188 -173.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -109.11 19.44 19.5 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.878 -1.138 . . . . 1.0 113.135 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.5 m170 -76.17 140.33 41.67 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 120.549 -1.344 . . . . 1.0 112.618 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 24.7 pt -143.03 160.65 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 126.394 1.877 . . . . 1.0 106.951 170.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -117.71 144.8 44.92 Favored 'General case' 0 N--CA 1.432 -1.33 0 O-C-N 119.3 -2.125 . . . . 1.0 108.982 176.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -127.5 146.04 50.64 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 119.938 -1.726 . . . . 1.0 107.455 168.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.9 ptpt -106.45 150.62 25.89 Favored 'General case' 0 CA--C 1.493 -1.22 0 O-C-N 120.111 -1.618 . . . . 1.0 111.311 165.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.4 p -119.22 124.52 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 N-CA-C 107.106 -1.442 . . . . 1.0 107.106 172.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 130.2 49.07 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 123.083 1.42 . . . . 1.0 112.739 -171.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -87.86 -179.02 47.59 Favored Glycine 0 N--CA 1.434 -1.442 0 CA-C-O 123.256 1.476 . . . . 1.0 115.801 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -91.36 -8.88 46.78 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 126.797 2.039 . . . . 1.0 109.474 175.262 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -112.3 7.27 19.26 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 127.761 2.424 . . . . 1.0 111.498 -173.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.43 3.88 90.54 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 116.839 1.495 . . . . 1.0 116.839 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -82.09 127.99 33.67 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 118.55 1.175 . . . . 1.0 111.656 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.4 t -139.86 140.11 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 O-C-N 121.286 -0.884 . . . . 1.0 110.922 -170.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -128.04 137.88 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 N-CA-C 106.08 -1.822 . . . . 1.0 106.08 163.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.43 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -117.73 140.15 50.07 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-O 123.61 1.671 . . . . 1.0 111.269 161.66 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.56 ' CD2' HG21 ' B' ' 967' ' ' ILE 0.355 10.8 t80 -139.91 140.48 36.44 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 -155.141 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.279 27.3 ttpt -115.02 115.64 27.16 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-O 122.403 1.097 . . . . 1.0 111.013 -171.191 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.402 HD12 ' HE1' ' A' ' 32' ' ' PHE . 3.1 tt -140.09 154.7 23.46 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-O 124.216 1.96 . . . . 1.0 111.997 -155.25 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -100.24 157.3 16.69 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 123.282 1.515 . . . . 1.0 111.758 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 ttt-85 -71.25 -23.12 61.93 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 117.848 2.536 . . . . 1.0 117.848 -154.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -90.44 -19.68 23.62 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.039 -1.663 . . . . 1.0 112.438 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.5 m -60.9 140.45 93.62 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 126.33 1.852 . . . . 1.0 114.132 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -68.62 152.05 74.76 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 CA-C-N 124.052 2.483 . . . . 1.0 116.308 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.291 0.4 OUTLIER -69.06 -25.47 64.47 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 126.657 1.983 . . . . 1.0 112.41 168.784 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 89.9 p -52.69 -29.15 25.02 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.098 -2.251 . . . . 1.0 115.024 173.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -67.74 -36.07 79.88 Favored 'General case' 0 N--CA 1.427 -1.614 0 O-C-N 119.75 -1.844 . . . . 1.0 110.686 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.431 ' HA ' ' CE2' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -63.57 -41.94 98.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 127.553 2.341 . . . . 1.0 112.497 171.011 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 56.1 ttm -61.53 -44.49 96.96 Favored 'General case' 0 N--CA 1.433 -1.28 0 O-C-N 120.857 -1.152 . . . . 1.0 113.7 174.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -67.21 -40.08 86.4 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.226 -0.921 . . . . 1.0 112.747 176.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.412 ' HB1' HD13 ' B' ' 967' ' ' ILE . . . -64.99 -38.6 91.49 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.763 -1.21 . . . . 1.0 113.686 179.176 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -59.77 -40.11 87.1 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.218 1.807 . . . . 1.0 111.907 170.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.9 m -67.72 -44.4 77.74 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.629 -1.92 . . . . 1.0 114.489 172.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.42 -46.51 76.26 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.054 -1.654 . . . . 1.0 114.045 179.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 24.6 mtt180 -78.59 -42.19 29.71 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 116.572 2.064 . . . . 1.0 116.572 177.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.15 4.83 25.29 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.8 -1.187 . . . . 1.0 112.001 -166.073 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.11 5.72 85.46 Favored Glycine 0 N--CA 1.438 -1.22 0 N-CA-C 117.856 1.902 . . . . 1.0 117.856 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.15 165.5 20.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.916 -1.344 . . . . 1.0 113.748 -173.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -102.34 129.71 48.87 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.326 -1.484 . . . . 1.0 111.036 171.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -66.47 -22.52 66.2 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 119.835 -1.791 . . . . 1.0 115.464 -172.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -91.29 3.87 53.77 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 124.937 1.295 . . . . 1.0 112.513 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -112.91 -6.12 13.8 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 124.622 1.169 . . . . 1.0 112.4 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 31.6 pt -124.35 142.46 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.694 -1.253 . . . . 1.0 110.263 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -138.21 154.93 49.09 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 124.86 1.264 . . . . 1.0 108.159 172.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -116.04 148.71 39.9 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-O 123.028 1.394 . . . . 1.0 112.923 -167.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -136.3 152.55 50.81 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-O 122.421 1.105 . . . . 1.0 110.072 175.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -130.55 111.58 12.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.728 1.211 . . . . 1.0 108.733 -178.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.8 t70 48.63 44.85 21.42 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 126.409 1.883 . . . . 1.0 113.997 -174.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.5 1.69 88.96 Favored Glycine 0 N--CA 1.436 -1.323 0 N-CA-C 117.051 1.58 . . . . 1.0 117.051 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -109.96 137.7 20.56 Favored Pre-proline 0 N--CA 1.436 -1.175 0 CA-C-N 119.978 1.889 . . . . 1.0 110.365 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.74 144.99 36.05 Favored 'Trans proline' 0 N--CA 1.44 -1.659 0 C-N-CA 122.616 2.211 . . . . 1.0 112.466 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.0 pt -120.75 151.28 23.64 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.141 0 C-N-CA 124.644 1.177 . . . . 1.0 108.828 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -112.7 163.42 14.58 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.8 -1.188 . . . . 1.0 109.803 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -70.19 -13.94 62.41 Favored 'General case' 0 N--CA 1.436 -1.142 0 O-C-N 119.726 -1.859 . . . . 1.0 112.895 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.0 m -84.55 -11.84 55.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 125.948 1.699 . . . . 1.0 112.164 171.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -83.43 173.19 11.72 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.449 -2.032 . . . . 1.0 110.721 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 76.9 p -153.48 159.23 32.38 Favored Pre-proline 0 CA--C 1.498 -1.055 0 O-C-N 120.748 -1.22 . . . . 1.0 111.027 -161.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.87 -32.27 95.05 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 C-N-CA 123.616 2.877 . . . . 1.0 115.17 171.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.29 -46.03 78.37 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-O 122.54 1.162 . . . . 1.0 113.59 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -69.58 -40.77 76.53 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 125.424 1.49 . . . . 1.0 113.452 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 16.4 tp -87.74 -8.4 56.09 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.811 -1.18 . . . . 1.0 111.696 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 60.13 48.25 8.59 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 127.5 2.32 . . . . 1.0 114.443 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.66 151.29 25.25 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 127.169 2.188 . . . . 1.0 115.081 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -105.6 175.95 5.32 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.089 1.756 . . . . 1.0 110.518 -175.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -56.26 -26.59 52.18 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 126.297 1.839 . . . . 1.0 115.528 176.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.73 89.69 2.34 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 124.438 1.095 . . . . 1.0 108.826 163.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.86 169.68 12.33 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.187 -1.57 . . . . 1.0 114.283 174.151 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.9 m -130.84 118.07 20.25 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 124.809 1.243 . . . . 1.0 111.012 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 24.2 mm -105.74 140.56 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 127.575 2.35 . . . . 1.0 107.981 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -110.98 142.58 42.92 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 120.445 -1.409 . . . . 1.0 109.2 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.5 139.64 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 O-C-N 120.494 -1.379 . . . . 1.0 109.297 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -123.71 140.67 52.76 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.714 -1.217 . . . . 1.0 107.714 165.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -86.03 133.12 33.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 120.966 -1.084 . . . . 1.0 109.893 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -139.24 151.46 46.53 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.939 -1.101 . . . . 1.0 112.532 -163.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -117.89 146.19 44.1 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.069 1.348 . . . . 1.0 108.472 176.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.7 t -56.18 145.15 27.15 Favored 'General case' 0 N--CA 1.438 -1.059 0 C-N-CA 125.024 1.33 . . . . 1.0 113.996 173.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -98.78 -2.04 57.36 Favored Glycine 0 CA--C 1.493 -1.341 0 O-C-N 120.588 -1.32 . . . . 1.0 113.326 177.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.733 0 CA-C-N 118.003 0.901 . . . . 1.0 111.52 -179.233 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.891 0 N-CA-C 115.276 0.871 . . . . 1.0 115.276 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 966' ' ' VAL . . . . . 0.418 ' HB ' ' O ' ' A' ' 31' ' ' GLN . 42.0 t -97.16 -69.28 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.189 0 CA-C-O 123.765 1.745 . . . . 1.0 110.836 173.094 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 967' ' ' ILE . . . . . 0.56 HG21 ' CD2' ' A' ' 32' ' ' PHE . 2.3 mt -113.12 118.43 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 C-N-CA 127.811 2.444 . . . . 1.0 111.432 -167.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -102.12 114.24 28.2 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.021 -1.674 . . . . 1.0 109.19 169.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.21 141.51 39.85 Favored 'General case' 0 CA--C 1.497 -1.07 0 CA-C-N 121.725 2.057 . . . . 1.0 115.476 -175.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 58.5 p -106.32 -10.88 16.19 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 125.488 1.515 . . . . 1.0 111.717 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -59.46 137.14 58.11 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 126.727 2.011 . . . . 1.0 113.183 171.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 42.1 t0 78.87 107.63 0.07 Allowed 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 128.348 2.659 . . . . 1.0 107.327 -167.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -90.02 36.09 0.86 Allowed 'General case' 0 N--CA 1.435 -1.21 0 O-C-N 119.946 -1.721 . . . . 1.0 114.387 -154.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -76.94 72.26 3.5 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 126.171 1.789 . . . . 1.0 110.177 162.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 C--O 1.26 1.639 0 C-N-CA 126.559 1.944 . . . . 1.0 115.815 -166.772 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 tpt . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 113.426 0.899 . . . . 1.0 113.426 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.24 -43.13 87.47 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 115.482 1.66 . . . . 1.0 115.482 -175.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -116.86 109.32 16.92 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 120.964 -1.085 . . . . 1.0 109.286 -178.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -154.26 158.13 39.76 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 108.504 -0.924 . . . . 1.0 108.504 173.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -93.57 126.06 51.43 Favored Pre-proline 0 N--CA 1.435 -1.215 0 CA-C-O 117.815 -1.088 . . . . 1.0 109.994 173.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -49.54 134.22 32.59 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 124.363 3.375 . . . . 1.0 117.111 171.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.63 -36.82 43.48 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 115.027 1.491 . . . . 1.0 115.027 -179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 62.85 27.47 16.03 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 117.257 2.318 . . . . 1.0 117.257 167.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 78.19 2.74 84.05 Favored Glycine 0 CA--C 1.493 -1.321 0 O-C-N 120.096 -1.627 . . . . 1.0 114.241 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.2 m -124.94 22.98 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.216 0 C-N-CA 125.27 1.428 . . . . 1.0 109.879 -173.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.68 146.35 0.07 Allowed 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 119.061 2.985 . . . . 1.0 119.061 177.192 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.7 p -74.05 163.76 27.48 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 115.231 1.567 . . . . 1.0 115.231 -173.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -142.5 -7.28 0.88 Allowed 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 113.56 0.948 . . . . 1.0 113.56 179.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -112.88 139.56 48.41 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.685 -1.259 . . . . 1.0 110.953 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -106.71 138.23 43.27 Favored 'General case' 0 N--CA 1.436 -1.136 0 O-C-N 120.546 -1.346 . . . . 1.0 111.799 -171.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.4 p-10 -160.19 175.59 12.73 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.411 2.285 . . . . 1.0 105.947 175.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.2 p-80 -58.77 163.25 3.45 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 118.602 2.816 . . . . 1.0 118.602 176.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 pt -139.39 160.78 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 C-N-CA 129.43 3.092 . . . . 1.0 107.297 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -111.94 144.86 40.58 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 119.844 -1.785 . . . . 1.0 109.926 165.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.15 156.69 46.94 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 119.361 -2.087 . . . . 1.0 107.071 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 ptpt -125.37 150.67 47.0 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 126.363 1.865 . . . . 1.0 112.833 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -117.55 124.82 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 125.295 1.438 . . . . 1.0 107.88 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.9 130.19 51.87 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-O 122.613 1.196 . . . . 1.0 113.418 -176.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -87.66 -177.16 48.22 Favored Glycine 0 N--CA 1.435 -1.386 0 C-N-CA 124.823 1.201 . . . . 1.0 113.349 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -75.68 -15.62 60.29 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.915 -1.344 . . . . 1.0 113.168 -177.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.9 p-10 -90.93 0.38 57.52 Favored 'General case' 0 N--CA 1.433 -1.293 0 C-N-CA 125.101 1.36 . . . . 1.0 111.577 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.57 0.16 89.75 Favored Glycine 0 CA--C 1.493 -1.331 0 C-N-CA 126.088 1.804 . . . . 1.0 113.668 179.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.4 m -70.67 128.12 35.0 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 124.936 1.295 . . . . 1.0 111.021 177.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.5 p -139.85 132.05 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.179 0 O-C-N 121.462 -0.774 . . . . 1.0 111.973 -166.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -129.17 138.72 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 O-C-N 120.619 -1.301 . . . . 1.0 109.923 176.069 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.75 146.56 46.92 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 124.025 1.869 . . . . 1.0 114.619 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.61 146.39 47.86 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.857 -1.777 . . . . 1.0 107.952 -163.03 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.255 37.5 ttpt -112.04 115.76 29.44 Favored 'General case' 0 CA--C 1.494 -1.188 0 O-C-N 120.482 -1.386 . . . . 1.0 111.822 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.98 154.58 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-O 124.24 1.971 . . . . 1.0 110.972 -160.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.31 158.97 19.55 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.608 -2.087 . . . . 1.0 112.625 -176.006 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ttt-85 -71.31 -38.02 71.77 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 115.817 1.784 . . . . 1.0 115.817 -161.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -91.06 -16.61 27.6 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.769 -1.207 . . . . 1.0 113.571 -178.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 63.8 m -63.37 138.18 97.28 Favored Pre-proline 0 N--CA 1.437 -1.117 0 C-N-CA 125.331 1.452 . . . . 1.0 112.566 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -65.74 156.27 64.85 Favored 'Trans proline' 0 N--CA 1.44 -1.66 0 CA-C-N 124.023 2.473 . . . . 1.0 116.306 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.422 1.8 pp -61.39 -25.62 67.3 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 126.317 1.847 . . . . 1.0 114.006 172.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 93.2 p -52.58 -29.02 23.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.944 -1.722 . . . . 1.0 114.879 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -42.66 77.4 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.5 -2.0 . . . . 1.0 112.73 -174.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.14 -35.44 80.48 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.362 -1.461 . . . . 1.0 113.208 170.207 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.9 ttt -61.42 -41.75 97.66 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.193 -1.567 . . . . 1.0 114.805 173.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.96 -43.03 99.69 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 125.761 1.624 . . . . 1.0 111.989 172.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.73 81.95 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 174.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -59.79 -43.42 94.44 Favored 'General case' 0 N--CA 1.437 -1.112 0 C-N-CA 126.213 1.805 . . . . 1.0 111.662 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.5 m -60.39 -43.41 96.68 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 125.249 1.419 . . . . 1.0 114.174 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.75 -51.55 54.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 114.99 1.478 . . . . 1.0 114.99 174.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -42.29 59.3 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.761 -1.212 . . . . 1.0 113.749 -172.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -112.33 0.47 15.7 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 113.053 0.76 . . . . 1.0 113.053 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 41.46 28.52 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 118.093 1.997 . . . . 1.0 118.093 163.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.4 mt -121.58 168.02 12.22 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.282 1.433 . . . . 1.0 111.215 -171.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 t -102.22 133.04 47.74 Favored 'General case' 0 N--CA 1.436 -1.149 0 O-C-N 120.502 -1.374 . . . . 1.0 112.927 176.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 23.8 ptp -66.55 -18.57 65.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.397 1.628 . . . . 1.0 115.397 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -96.59 1.52 51.33 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.613 -1.304 . . . . 1.0 113.061 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -110.37 -31.5 7.27 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 119.722 -1.861 . . . . 1.0 111.769 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.2 pp -115.27 135.25 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 O-C-N 121.615 -0.678 . . . . 1.0 110.661 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -132.75 154.93 49.74 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.137 -1.602 . . . . 1.0 111.329 -171.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.425 ' HB3' HD11 ' A' ' 67' ' ' ILE . 16.9 m-30 -104.17 148.66 26.04 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.297 -1.502 . . . . 1.0 113.055 -166.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -147.34 145.1 29.2 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 125.079 1.352 . . . . 1.0 108.213 -171.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -129.97 110.29 11.55 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 120.615 -1.303 . . . . 1.0 109.026 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 52.57 47.15 25.31 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.757 2.023 . . . . 1.0 114.038 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.93 4.89 86.39 Favored Glycine 0 N--CA 1.435 -1.416 0 O-C-N 120.371 -1.456 . . . . 1.0 116.289 -176.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -114.6 132.2 22.99 Favored Pre-proline 0 N--CA 1.434 -1.238 0 CA-C-N 120.386 2.093 . . . . 1.0 109.08 -177.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.63 135.26 34.05 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 123.869 3.046 . . . . 1.0 115.797 163.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.425 HD11 ' HB3' ' A' ' 60' ' ' PHE . 4.7 pt -119.66 142.85 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 105.943 -1.873 . . . . 1.0 105.943 174.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -100.14 158.25 15.99 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.796 -1.19 . . . . 1.0 108.574 -169.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -66.12 -26.0 67.25 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 119.382 -2.074 . . . . 1.0 113.569 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.3 m -78.48 -12.63 60.02 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 126.215 1.806 . . . . 1.0 113.213 171.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.94 172.64 11.9 Favored 'General case' 0 N--CA 1.432 -1.343 0 O-C-N 118.663 -2.523 . . . . 1.0 111.711 174.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 54.4 p -148.11 160.83 36.39 Favored Pre-proline 0 CA--C 1.495 -1.143 0 O-C-N 120.094 -1.629 . . . . 1.0 109.24 -159.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 99.7 Cg_exo -55.83 -36.14 94.9 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.275 2.65 . . . . 1.0 115.909 164.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.45 -45.7 82.72 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 114.124 1.157 . . . . 1.0 114.124 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -71.66 -43.16 66.55 Favored 'General case' 0 N--CA 1.433 -1.299 0 C-N-CA 124.694 1.197 . . . . 1.0 111.886 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -4.56 56.41 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.81 0.814 . . . . 1.0 111.754 -175.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.267 51.2 mt-10 60.02 48.33 8.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 C-N-CA 127.129 2.172 . . . . 1.0 115.106 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.9 mtt -73.64 153.6 40.08 Favored 'General case' 0 N--CA 1.432 -1.335 0 C-N-CA 126.653 1.981 . . . . 1.0 111.675 173.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.579 ' HG3' ' H ' ' A' ' 81' ' ' GLU . 10.7 pt-20 -118.14 178.7 4.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 O-C-N 120.568 -1.333 . . . . 1.0 110.606 -168.207 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.259 9.6 p-10 -52.92 -26.55 15.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.987 2.515 . . . . 1.0 116.556 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.579 ' H ' ' HG3' ' A' ' 79' ' ' GLU . 50.9 mt-10 -136.61 66.32 1.48 Allowed 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 125.12 1.368 . . . . 1.0 111.854 167.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.73 167.35 19.22 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 116.966 2.21 . . . . 1.0 116.966 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.4 m -127.63 125.38 40.07 Favored 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 126.17 1.788 . . . . 1.0 112.121 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 73.9 mt -114.33 140.76 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 C-N-CA 129.233 3.013 . . . . 1.0 109.172 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -110.9 141.48 44.26 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.965 1.706 . . . . 1.0 106.597 -171.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.7 t -108.54 131.6 58.68 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.257 0 O-C-N 120.783 -1.198 . . . . 1.0 108.82 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -118.46 135.31 54.44 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 123.456 1.598 . . . . 1.0 111.822 164.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.14 140.5 29.4 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 125.414 1.486 . . . . 1.0 111.816 -172.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 -121.08 3.96 10.42 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 121.077 -1.014 . . . . 1.0 111.67 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -56.66 -45.12 81.86 Favored 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 126.521 1.928 . . . . 1.0 115.772 -175.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 34.7 p -99.24 -3.85 33.3 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.525 -1.36 . . . . 1.0 111.607 -175.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 63.26 -179.15 5.94 Favored Glycine 0 N--CA 1.435 -1.382 0 C-N-CA 125.964 1.745 . . . . 1.0 116.74 -177.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.749 0 O-C-N 120.717 -1.461 . . . . 1.0 109.673 -177.126 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.937 0 CA-C-O 120.256 -0.191 . . . . 1.0 113.442 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.292 0.2 OUTLIER -74.92 -50.28 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 N-CA-C 116.381 1.993 . . . . 1.0 116.381 -166.482 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -113.05 115.22 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 124.573 1.149 . . . . 1.0 109.276 -168.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -102.16 122.94 45.13 Favored 'General case' 0 N--CA 1.434 -1.237 0 O-C-N 120.139 -1.6 . . . . 1.0 110.364 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 969' ' ' LEU . . . . . 0.415 ' HA ' HD13 ' B' ' 969' ' ' LEU . 3.2 mm? -91.96 140.96 29.15 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.167 -1.583 . . . . 1.0 114.989 -175.001 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 23.2 m -122.64 131.56 53.87 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 105.531 -2.026 . . . . 1.0 105.531 165.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.47 168.75 24.43 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.884 -1.135 . . . . 1.0 109.782 -174.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.43 -43.48 90.31 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 125.87 1.668 . . . . 1.0 115.182 -168.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -61.56 140.43 58.12 Favored 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 125.801 1.64 . . . . 1.0 113.658 -173.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -58.09 134.47 56.47 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 114.276 1.213 . . . . 1.0 114.276 174.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.272 40.3 tt0 . . . . . 0 C--O 1.262 1.743 0 N-CA-C 115.121 1.526 . . . . 1.0 115.121 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 m170 . . . . . 0 N--CA 1.433 -1.317 0 CA-C-O 121.77 0.795 . . . . 1.0 112.609 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.9 pt -143.03 160.72 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 C-N-CA 131.29 3.836 . . . . 1.0 106.541 -174.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -116.05 144.85 43.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.769 -2.457 . . . . 1.0 110.566 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.459 HD22 HG21 ' A' ' 34' ' ' ILE . 1.8 pt? -132.25 157.2 44.97 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 119.375 -2.078 . . . . 1.0 106.084 173.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.3 ptpt -122.25 150.0 42.91 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 120.009 -1.682 . . . . 1.0 110.456 168.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.46 126.05 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.01 130.21 53.1 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 122.876 1.322 . . . . 1.0 112.114 -176.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.505 0 CA-C-O 123.351 1.528 . . . . 1.0 115.133 178.61 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.436 -1.13 0 N-CA-C 112.782 0.66 . . . . 1.0 112.782 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.549 ' CG2' HG21 ' B' ' 966' ' ' VAL . 0.4 OUTLIER -129.19 138.78 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.067 0 O-C-N 120.566 -1.334 . . . . 1.0 110.178 170.174 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.46 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -104.07 158.49 16.39 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 123.406 1.574 . . . . 1.0 112.687 174.483 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.482 ' CD2' HD13 ' B' ' 967' ' ' ILE . 0.1 OUTLIER -145.03 152.49 40.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.725 -1.125 . . . . 1.0 108.099 -173.285 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -124.12 118.3 26.6 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.768 -1.568 . . . . 1.0 106.768 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.568 ' HA ' HD21 ' B' ' 969' ' ' LEU . 12.7 tt -144.49 154.83 14.84 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 C-N-CA 128.247 2.619 . . . . 1.0 111.113 -154.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -102.09 157.11 17.12 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 112.054 -2.339 . . . . 1.0 112.118 -177.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.09 -37.97 78.73 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 115.816 1.784 . . . . 1.0 115.816 -158.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -82.77 -17.97 42.32 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 114.344 1.238 . . . . 1.0 114.344 176.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 31.9 m -61.59 131.75 92.8 Favored Pre-proline 0 N--CA 1.438 -1.032 0 C-N-CA 125.479 1.511 . . . . 1.0 112.148 -175.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.78 157.08 62.96 Favored 'Trans proline' 0 N--CA 1.441 -1.606 0 CA-C-N 124.881 2.779 . . . . 1.0 114.914 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.433 2.7 pp -61.98 -25.55 67.69 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 124.958 1.303 . . . . 1.0 114.484 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.0 p -52.67 -29.02 24.2 Favored 'General case' 0 N--CA 1.435 -1.218 0 O-C-N 119.803 -1.811 . . . . 1.0 114.897 171.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -44.17 65.43 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 119.754 -1.841 . . . . 1.0 111.521 -175.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -35.58 80.0 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.898 -1.126 . . . . 1.0 111.957 175.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 ttm -61.65 -42.09 98.42 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 119.778 -1.826 . . . . 1.0 114.11 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 ttpt -69.14 -37.17 78.15 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.147 -1.595 . . . . 1.0 112.503 175.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.65 83.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 114.238 1.199 . . . . 1.0 114.238 171.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -59.13 -43.31 91.97 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.911 -1.743 . . . . 1.0 111.897 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 81.2 m -62.53 -42.46 99.54 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 125.009 1.323 . . . . 1.0 113.769 175.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.14 -48.89 78.08 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 124.594 1.157 . . . . 1.0 113.754 175.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -78.57 -43.16 27.25 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 114.85 1.426 . . . . 1.0 114.85 -174.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -114.16 9.59 17.18 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.934 -1.104 . . . . 1.0 112.793 -165.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.08 46.99 8.75 Favored Glycine 0 CA--C 1.493 -1.281 0 N-CA-C 117.67 1.828 . . . . 1.0 117.67 161.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.7 mt -125.59 160.95 28.32 Favored 'General case' 0 N--CA 1.436 -1.167 0 C-N-CA 124.566 1.147 . . . . 1.0 109.825 -170.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 m -102.28 133.81 46.59 Favored 'General case' 0 CA--C 1.496 -1.118 0 O-C-N 120.295 -1.503 . . . . 1.0 110.218 172.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -63.74 -32.59 74.13 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 116.527 2.047 . . . . 1.0 116.527 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -78.99 -14.71 59.04 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.19 -1.569 . . . . 1.0 114.024 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -87.73 -16.83 33.14 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.882 -1.136 . . . . 1.0 112.616 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.1 pt -116.37 140.47 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 O-C-N 120.814 -1.179 . . . . 1.0 108.987 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -138.21 146.33 42.49 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 107.265 -1.383 . . . . 1.0 107.265 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.1 m-30 -107.15 148.58 28.66 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.505 1.145 . . . . 1.0 110.663 -170.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -131.98 153.95 49.81 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 124.844 1.258 . . . . 1.0 109.346 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -126.12 108.69 11.57 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 165.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 48.71 50.49 17.21 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.098 2.159 . . . . 1.0 115.371 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.62 6.57 89.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 116.186 1.234 . . . . 1.0 116.186 -177.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -110.62 127.67 26.58 Favored Pre-proline 0 N--CA 1.435 -1.199 0 CA-C-N 119.564 1.682 . . . . 1.0 109.411 176.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -56.13 135.23 68.84 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 123.237 2.624 . . . . 1.0 115.54 166.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.4 pt -119.29 137.6 52.69 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 106.236 -1.764 . . . . 1.0 106.236 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -112.67 163.83 14.08 Favored 'General case' 0 N--CA 1.435 -1.206 0 O-C-N 120.717 -1.239 . . . . 1.0 108.433 -162.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -61.44 -28.3 69.17 Favored 'General case' 0 CA--C 1.497 -1.092 0 O-C-N 118.98 -2.325 . . . . 1.0 115.731 -175.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.1 m -78.51 -13.93 59.6 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 126.086 1.754 . . . . 1.0 112.459 175.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -75.89 168.93 19.12 Favored 'General case' 0 N--CA 1.432 -1.357 0 O-C-N 119.627 -1.92 . . . . 1.0 111.363 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p -151.43 161.72 28.83 Favored Pre-proline 0 CA--C 1.497 -1.081 0 O-C-N 119.878 -1.764 . . . . 1.0 111.047 -154.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -60.4 -31.69 92.98 Favored 'Trans proline' 0 N--CA 1.44 -1.649 0 C-N-CA 123.6 2.867 . . . . 1.0 115.417 168.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.87 -45.5 70.85 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 122.508 1.147 . . . . 1.0 112.65 173.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -70.48 -42.81 70.89 Favored 'General case' 0 N--CA 1.433 -1.295 0 C-N-CA 125.501 1.521 . . . . 1.0 113.729 -177.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 25.9 tp -85.82 -8.46 58.08 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.557 -1.339 . . . . 1.0 113.008 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 67.39 42.63 2.15 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.549 1.539 . . . . 1.0 113.608 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 63.9 mtt -62.3 148.73 44.11 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 127.065 2.146 . . . . 1.0 115.184 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -91.53 176.48 6.53 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.472 1.509 . . . . 1.0 111.431 -178.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.259 12.1 p-10 -58.16 -26.39 62.66 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.437 2.295 . . . . 1.0 114.477 168.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -138.26 79.15 1.72 Allowed 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 125.35 1.46 . . . . 1.0 109.686 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.68 162.44 21.82 Favored 'General case' 0 N--CA 1.437 -1.094 0 O-C-N 120.021 -1.674 . . . . 1.0 112.483 176.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.8 m -131.21 118.57 20.62 Favored 'General case' 0 CA--C 1.496 -1.11 0 C-N-CA 124.297 1.039 . . . . 1.0 110.332 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mm -119.18 140.6 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 C-N-CA 126.828 2.051 . . . . 1.0 108.937 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -111.05 149.45 30.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.281 -1.512 . . . . 1.0 110.989 -170.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.0 t -115.76 139.63 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 O-C-N 120.665 -1.272 . . . . 1.0 110.625 -174.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -121.63 142.87 49.7 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.426 -0.953 . . . . 1.0 108.426 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -89.56 120.29 30.73 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 120.864 -1.147 . . . . 1.0 109.216 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 . . . . . 0 N--CA 1.435 -1.213 0 N-CA-C 114.822 1.415 . . . . 1.0 114.822 -154.874 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . 0.549 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.481 0.3 OUTLIER . . . . . 0 N--CA 1.434 -1.252 0 N-CA-C 112.635 0.606 . . . . 1.0 112.635 . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . 0.482 HD13 ' CD2' ' A' ' 32' ' ' PHE . 4.9 mt -88.82 116.61 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 O-C-N 119.857 -1.777 . . . . 1.0 113.259 -163.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -102.17 109.24 20.88 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 118.903 -2.373 . . . . 1.0 109.132 160.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.498 -1.053 0 O-C-N 119.651 -1.906 . . . . 1.0 114.389 -168.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 m80 . . . . . 0 N--CA 1.431 -1.417 0 CA-C-O 122.67 1.224 . . . . 1.0 109.271 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.7 pt -139.38 160.7 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 126.461 1.904 . . . . 1.0 107.282 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -117.7 144.73 44.98 Favored 'General case' 0 N--CA 1.432 -1.329 0 N-CA-C 106.092 -1.818 . . . . 1.0 106.092 170.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.7 156.06 45.56 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 105.256 -2.128 . . . . 1.0 105.256 168.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -115.72 150.61 36.55 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 125.786 1.635 . . . . 1.0 109.91 169.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.411 HG11 ' CZ ' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -111.28 127.59 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.675 0 N-CA-C 105.719 -1.956 . . . . 1.0 105.719 171.619 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -130.3 130.15 44.14 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.163 0.982 . . . . 1.0 111.581 -174.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.395 0 N-CA-C 108.548 -1.821 . . . . 1.0 108.548 172.782 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.437 -1.115 0 N-CA-C 112.273 0.472 . . . . 1.0 112.273 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.258 0.4 OUTLIER -129.25 138.8 53.45 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.083 0 O-C-N 119.636 -1.915 . . . . 1.0 110.531 158.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.06 139.54 53.18 Favored 'General case' 0 CA--C 1.494 -1.202 0 CA-C-O 123.425 1.583 . . . . 1.0 113.479 175.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.496 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.1 OUTLIER -144.06 146.86 33.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.745 -1.222 . . . . 1.0 112.963 -165.339 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.269 20.5 ttpt -112.78 115.85 29.15 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.858 1.263 . . . . 1.0 113.371 -166.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.9 154.67 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 123.576 1.655 . . . . 1.0 110.878 -152.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -106.63 165.72 11.09 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 123.298 1.523 . . . . 1.0 114.217 -170.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -62.97 -38.17 90.04 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.193 2.294 . . . . 1.0 117.193 -159.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.28 15.88 21.58 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.536 -1.353 . . . . 1.0 113.764 -178.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 16.1 m -84.08 135.93 41.58 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 124.855 1.262 . . . . 1.0 111.723 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.13 152.6 76.19 Favored 'Trans proline' 0 N--CA 1.441 -1.571 0 C-N-CA 123.039 2.492 . . . . 1.0 114.576 173.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.332 3.4 pp -61.88 -25.69 67.7 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 114.405 1.261 . . . . 1.0 114.405 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 83.7 p -52.72 -29.06 24.81 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 119.538 -1.976 . . . . 1.0 116.067 166.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -74.55 -45.88 42.68 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 119.557 -1.965 . . . . 1.0 110.618 -167.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.739 HD13 ' H ' ' A' ' 43' ' ' LEU 0.327 0.0 OUTLIER -68.85 -31.13 69.86 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.695 1.368 . . . . 1.0 114.695 170.233 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 18.4 ttt -61.04 -41.72 97.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.397 -2.065 . . . . 1.0 114.065 173.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -41.52 98.65 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 120.876 -1.14 . . . . 1.0 112.418 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.61 -36.84 81.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.118 1.525 . . . . 1.0 115.118 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -58.94 -43.86 91.28 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 120.025 -1.672 . . . . 1.0 112.185 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.2 m -62.3 -42.36 99.3 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.009 1.324 . . . . 1.0 113.02 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -67.19 -51.52 52.51 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 113.464 0.913 . . . . 1.0 113.464 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.7 -40.68 72.72 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 115.067 1.506 . . . . 1.0 115.067 -174.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -111.13 9.82 21.94 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.915 -1.116 . . . . 1.0 112.513 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.34 Favored Glycine 0 CA--C 1.493 -1.303 0 N-CA-C 115.871 1.108 . . . . 1.0 115.871 164.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.3 mt -116.92 160.41 20.95 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.73 -0.865 . . . . 1.0 111.725 -169.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.0 m -102.23 134.5 45.41 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 121.073 -1.017 . . . . 1.0 109.071 175.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 tpp -61.4 -37.91 85.16 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 127.276 2.23 . . . . 1.0 114.08 -165.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -95.82 1.38 53.12 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.481 -0.781 . . . . 1.0 112.072 -176.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -102.15 -3.98 26.58 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.342 1.057 . . . . 1.0 111.694 177.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.9 pt -123.33 146.12 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 124.471 1.108 . . . . 1.0 108.991 168.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -138.26 148.78 45.07 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 120.65 -1.281 . . . . 1.0 107.682 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.411 ' CZ ' HG11 ' A' ' 22' ' ' VAL . 20.2 m-30 -103.32 147.54 26.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 122.757 1.265 . . . . 1.0 111.854 -176.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -131.19 161.19 32.74 Favored 'General case' 0 N--CA 1.433 -1.317 0 C-N-CA 125.809 1.643 . . . . 1.0 108.135 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -138.57 124.12 19.58 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 107.615 -1.254 . . . . 1.0 107.615 165.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.4 t0 58.54 32.53 22.23 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.591 1.556 . . . . 1.0 114.859 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.42 8.47 87.53 Favored Glycine 0 N--CA 1.435 -1.382 0 O-C-N 119.953 -1.717 . . . . 1.0 116.104 -173.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -117.14 142.14 29.58 Favored Pre-proline 0 N--CA 1.434 -1.234 0 CA-C-N 119.028 1.414 . . . . 1.0 108.481 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -74.7 142.4 28.82 Favored 'Trans proline' 0 C--N 1.307 -1.617 0 CA-C-N 123.286 2.209 . . . . 1.0 112.271 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 pt -116.83 143.84 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 N-CA-C 106.571 -1.64 . . . . 1.0 106.571 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -89.52 154.69 19.81 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 119.592 -1.943 . . . . 1.0 109.815 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -61.06 -27.71 68.54 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 118.845 -2.409 . . . . 1.0 115.217 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 m -95.51 5.64 51.02 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 124.218 1.007 . . . . 1.0 111.758 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -74.56 174.89 8.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.256 -2.153 . . . . 1.0 110.36 165.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.9 p -150.41 163.29 24.73 Favored Pre-proline 0 CA--C 1.498 -1.028 0 O-C-N 119.375 -2.078 . . . . 1.0 112.556 -153.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -57.48 -33.86 97.07 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 123.857 3.038 . . . . 1.0 116.253 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.8 -44.75 69.42 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 122.499 1.143 . . . . 1.0 113.027 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.51 -43.96 79.61 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 124.839 1.255 . . . . 1.0 113.334 -178.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.3 tp -90.83 -8.42 49.62 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.901 -1.124 . . . . 1.0 112.58 -178.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 62.29 44.96 7.09 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 126.794 2.038 . . . . 1.0 114.532 -178.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.6 mtt -59.41 151.32 24.11 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 127.074 2.149 . . . . 1.0 112.868 171.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -120.58 177.76 4.94 Favored 'General case' 0 N--CA 1.432 -1.333 0 O-C-N 121.213 -0.93 . . . . 1.0 109.073 -170.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -56.74 -26.77 57.94 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 127.695 2.398 . . . . 1.0 115.426 -175.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -136.07 83.21 1.99 Allowed 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 123.872 0.869 . . . . 1.0 109.101 162.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.4 166.36 19.48 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 120.121 -1.612 . . . . 1.0 114.581 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 m -132.58 118.42 19.18 Favored 'General case' 0 CA--C 1.496 -1.13 0 C-N-CA 124.503 1.121 . . . . 1.0 110.925 173.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.7 mm -108.64 140.94 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 C-N-CA 129.502 3.121 . . . . 1.0 109.595 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -110.83 134.33 52.61 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 119.465 -2.022 . . . . 1.0 107.615 -164.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 t -110.95 126.71 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-O 121.643 0.735 . . . . 1.0 109.339 -173.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -116.43 143.08 46.02 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-O 122.201 1.0 . . . . 1.0 110.836 170.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -88.16 139.82 30.11 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.547 -1.346 . . . . 1.0 112.703 -175.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.434 -1.233 0 C-N-CA 124.385 1.074 . . . . 1.0 109.769 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 12.4 t . . . . . 0 N--CA 1.436 -1.162 0 CA-C-O 124.023 1.868 . . . . 1.0 111.57 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . 0.496 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 8.4 mt -113.13 124.81 70.14 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.27 0 C-N-CA 127.327 2.251 . . . . 1.0 111.13 -168.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -102.1 125.41 48.78 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 106.424 -1.695 . . . . 1.0 106.424 163.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.5 -0.951 0 N-CA-C 119.298 3.073 . . . . 1.0 119.298 -157.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.437 -1.119 0 N-CA-C 116.176 1.917 . . . . 1.0 116.176 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 37.0 pt -138.86 160.74 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 126.145 1.778 . . . . 1.0 108.556 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -117.76 144.91 44.87 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 119.179 -2.201 . . . . 1.0 108.035 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 34' ' ' ILE . 1.6 pt? -127.43 157.09 40.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 119.219 -2.175 . . . . 1.0 105.433 169.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -120.41 150.6 40.53 Favored 'General case' 0 N--CA 1.432 -1.369 0 O-C-N 119.498 -2.001 . . . . 1.0 111.482 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -118.44 122.1 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 N-CA-C 106.023 -1.843 . . . . 1.0 106.023 177.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.13 131.64 54.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.543 1.137 . . . . 1.0 111.631 -169.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.45 0 N-CA-C 109.465 -1.454 . . . . 1.0 109.465 177.034 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.433 -1.279 0 N-CA-C 111.563 0.209 . . . . 1.0 111.563 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.42 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.256 0.5 OUTLIER -129.14 138.68 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 O-C-N 120.355 -1.466 . . . . 1.0 110.88 168.35 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.01 144.98 46.23 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 124.911 2.291 . . . . 1.0 113.963 -175.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.405 ' CD2' HD13 ' B' ' 967' ' ' ILE . 0.3 OUTLIER -132.96 140.66 47.92 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.806 -1.809 . . . . 1.0 107.338 -165.655 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -108.47 118.51 36.96 Favored 'General case' 0 N--CA 1.434 -1.258 0 C-N-CA 126.415 1.886 . . . . 1.0 111.78 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.515 ' HB ' HD11 ' B' ' 969' ' ' LEU . 9.2 tt -147.91 154.73 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.351 0 CA-C-O 124.954 2.311 . . . . 1.0 110.646 -148.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -117.27 160.29 21.33 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 112.511 -2.131 . . . . 1.0 111.84 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -62.15 -38.13 87.83 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 117.4 2.37 . . . . 1.0 117.4 -159.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -74.49 -25.14 59.19 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.346 -1.471 . . . . 1.0 114.36 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.7 m -62.69 127.76 90.79 Favored Pre-proline 0 N--CA 1.436 -1.134 0 C-N-CA 125.885 1.674 . . . . 1.0 114.5 -172.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -69.81 158.47 56.79 Favored 'Trans proline' 0 N--CA 1.441 -1.582 0 C-N-CA 122.895 2.397 . . . . 1.0 113.986 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.439 2.8 pp -59.34 -25.48 64.24 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 114.565 1.32 . . . . 1.0 114.565 177.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 t -52.71 -29.03 24.55 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 120.154 -1.592 . . . . 1.0 113.738 171.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -43.28 88.38 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 119.959 -1.713 . . . . 1.0 113.24 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.43 HD13 ' H ' ' A' ' 43' ' ' LEU 0.421 0.0 OUTLIER -70.31 -31.22 68.45 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 171.169 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.6 tpp -60.22 -45.92 91.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 O-C-N 120.466 -1.396 . . . . 1.0 113.132 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -43.88 98.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 120.909 -1.12 . . . . 1.0 112.552 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.22 79.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.07 1.137 . . . . 1.0 114.07 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -62.7 -44.16 96.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 120.395 -1.44 . . . . 1.0 111.781 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.0 m -62.93 -41.86 99.62 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.731 1.213 . . . . 1.0 114.095 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -68.19 -51.32 47.02 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.984 -1.697 . . . . 1.0 114.868 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.406 ' HD2' HG23 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -72.63 -43.17 63.6 Favored 'General case' 0 CA--C 1.496 -1.116 0 O-C-N 120.049 -1.657 . . . . 1.0 113.749 -173.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -112.46 6.97 18.89 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 123.84 0.856 . . . . 1.0 113.036 -170.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.63 3.04 89.86 Favored Glycine 0 N--CA 1.437 -1.247 0 N-CA-C 118.631 2.212 . . . . 1.0 118.631 162.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.18 166.46 23.21 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.746 1.758 . . . . 1.0 115.746 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.1 m -102.25 129.42 48.65 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.549 -1.344 . . . . 1.0 110.455 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -66.55 -21.24 66.16 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 115.681 1.734 . . . . 1.0 115.681 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ptt-85 -77.85 -17.88 56.89 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.75 -1.219 . . . . 1.0 113.462 176.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -94.79 -16.82 22.68 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.392 1.077 . . . . 1.0 112.353 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.5 pt -119.98 141.2 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.2 0 C-N-CA 124.647 1.179 . . . . 1.0 110.251 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 154.94 49.04 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 107.001 -1.481 . . . . 1.0 107.001 171.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -113.2 148.67 34.99 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 122.302 1.049 . . . . 1.0 110.98 -171.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 41.2 ptt180 -137.51 158.15 45.01 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.753 -1.217 . . . . 1.0 111.525 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -137.52 121.2 17.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.51 -0.922 . . . . 1.0 108.51 174.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t70 56.4 40.35 29.74 Favored 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 126.223 1.809 . . . . 1.0 112.99 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.52 3.43 86.48 Favored Glycine 0 N--CA 1.438 -1.205 0 O-C-N 120.095 -1.628 . . . . 1.0 116.273 -176.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -116.65 139.76 25.93 Favored Pre-proline 0 N--CA 1.435 -1.189 0 CA-C-N 119.548 1.674 . . . . 1.0 110.493 -172.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.65 142.64 32.74 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.78 2.32 . . . . 1.0 112.84 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 pt -117.82 147.07 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 C-N-CA 125.439 1.496 . . . . 1.0 108.849 -178.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -109.18 160.58 15.97 Favored 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 120.755 -1.216 . . . . 1.0 110.849 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -69.84 -14.28 62.67 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 119.157 -2.214 . . . . 1.0 114.969 -177.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 95.8 m -99.34 0.46 42.95 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 124.849 1.26 . . . . 1.0 111.714 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -76.75 168.95 19.19 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 118.275 -2.766 . . . . 1.0 109.87 161.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 p -152.77 163.62 22.94 Favored Pre-proline 0 CA--C 1.497 -1.09 0 O-C-N 119.69 -1.881 . . . . 1.0 111.035 -155.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -58.4 -32.87 97.19 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 123.516 2.811 . . . . 1.0 115.781 167.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.82 -45.96 55.66 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 122.123 0.963 . . . . 1.0 112.57 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -66.86 -40.66 87.95 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 125.676 1.591 . . . . 1.0 113.423 -176.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -88.24 -8.34 55.41 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 121.123 -0.986 . . . . 1.0 112.272 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 62.88 48.21 4.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 126.501 1.92 . . . . 1.0 113.65 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.4 mtt -61.19 154.2 23.99 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.727 2.011 . . . . 1.0 112.792 170.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -114.26 -178.4 3.36 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 -172.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.39 10.2 p-10 -55.05 -26.61 38.69 Favored 'General case' 0 N--CA 1.435 -1.225 0 N-CA-C 116.654 2.094 . . . . 1.0 116.654 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -141.27 73.04 1.4 Allowed 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 125.469 1.508 . . . . 1.0 110.27 174.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.19 164.9 24.54 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 116.077 1.881 . . . . 1.0 116.077 -174.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.1 m -131.77 115.39 15.91 Favored 'General case' 0 CA--C 1.495 -1.149 0 C-N-CA 124.439 1.096 . . . . 1.0 111.361 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.4 mm -117.9 140.68 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 C-N-CA 126.84 2.056 . . . . 1.0 108.745 -175.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.92 145.7 37.87 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.139 -1.601 . . . . 1.0 110.02 -166.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.6 t -108.56 135.21 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 124.297 1.039 . . . . 1.0 109.014 -177.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -121.83 136.35 54.93 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 122.678 1.228 . . . . 1.0 109.637 164.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -87.93 132.56 34.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 124.268 1.027 . . . . 1.0 110.413 -173.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 96.8 mm-40 . . . . . 0 N--CA 1.433 -1.278 0 N-CA-C 115.593 1.701 . . . . 1.0 115.593 -168.802 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . 0.42 HG21 ' CG2' ' A' ' 30' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.434 -1.26 0 N-CA-C 113.964 1.098 . . . . 1.0 113.964 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . 0.43 HG22 HD23 ' B' ' 969' ' ' LEU . 4.7 mt -112.43 116.32 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-O 121.993 0.901 . . . . 1.0 109.715 -169.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.07 103.68 14.27 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 120.463 -1.398 . . . . 1.0 108.803 174.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.515 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.071 0 O-C-N 119.731 -1.856 . . . . 1.0 115.077 -171.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 p80 . . . . . 0 N--CA 1.431 -1.414 0 CA-C-O 122.454 1.121 . . . . 1.0 112.64 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.8 pt -133.4 160.74 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.296 0 C-N-CA 129.47 3.108 . . . . 1.0 106.173 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.0 m-20 -113.12 144.81 42.01 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 118.885 -2.385 . . . . 1.0 108.185 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.837 HD22 HG21 ' A' ' 34' ' ' ILE . 1.3 pt? -128.37 155.91 43.95 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 105.967 -1.864 . . . . 1.0 105.967 171.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.425 ' HD3' HG21 ' A' ' 29' ' ' VAL . 12.9 ptpt -123.87 150.6 44.42 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 120.495 -1.378 . . . . 1.0 111.968 172.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -118.93 119.25 60.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.178 0 N-CA-C 108.038 -1.097 . . . . 1.0 108.038 177.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.44 130.22 54.23 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 122.389 1.09 . . . . 1.0 113.268 -165.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.523 0 CA-C-O 122.882 1.268 . . . . 1.0 111.991 173.732 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.425 HG21 ' HD3' ' A' ' 21' ' ' LYS . 1.6 p . . . . . 0 N--CA 1.428 -1.546 0 N-CA-C 106.715 -1.587 . . . . 1.0 106.715 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.738 HG22 HG11 ' B' ' 966' ' ' VAL . 0.8 OUTLIER -121.4 133.34 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 O-C-N 120.931 -1.105 . . . . 1.0 109.027 170.761 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.417 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -99.3 160.84 13.98 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.54 3.067 . . . . 1.0 114.583 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -145.1 140.54 28.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.297 -2.127 . . . . 1.0 105.526 -175.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -100.22 117.77 35.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 C-N-CA 127.317 2.247 . . . . 1.0 107.657 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.837 HG21 HD22 ' A' ' 20' ' ' LEU . 12.3 tt -146.1 154.87 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.281 0 C-N-CA 127.937 2.495 . . . . 1.0 111.33 -151.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.73 167.54 13.34 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 113.595 -1.638 . . . . 1.0 113.705 -174.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -66.57 -38.21 86.59 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 116.989 2.218 . . . . 1.0 116.989 -162.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -87.11 -27.78 22.9 Favored 'General case' 0 CA--C 1.494 -1.175 0 O-C-N 120.2 -1.562 . . . . 1.0 111.226 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.6 m -57.75 111.99 4.19 Favored Pre-proline 0 N--CA 1.436 -1.13 0 C-N-CA 127.834 2.454 . . . . 1.0 113.686 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -67.47 163.19 35.75 Favored 'Trans proline' 0 N--CA 1.441 -1.607 0 C-N-CA 124.055 3.17 . . . . 1.0 116.081 -172.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.45 2.5 pp -64.74 -25.59 68.0 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.087 1.514 . . . . 1.0 115.087 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 97.3 p -52.68 -29.1 24.68 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.876 -1.765 . . . . 1.0 114.915 168.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.18 -43.92 80.96 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.214 -1.554 . . . . 1.0 112.094 -177.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.424 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -68.4 -35.59 77.88 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.555 -1.341 . . . . 1.0 113.568 171.635 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.3 ttm -60.59 -43.65 97.14 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.318 -1.488 . . . . 1.0 114.207 176.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -66.72 -39.44 88.02 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.517 -1.364 . . . . 1.0 112.971 174.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.91 82.66 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.249 -1.532 . . . . 1.0 114.392 177.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -58.54 -43.85 89.39 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 126.542 1.937 . . . . 1.0 110.863 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.9 m -62.01 -41.75 98.42 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 120.332 -1.48 . . . . 1.0 114.055 174.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -67.15 -47.71 70.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 114.707 1.373 . . . . 1.0 114.707 175.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -73.14 -43.25 61.89 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 115.892 1.812 . . . . 1.0 115.892 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -112.49 4.17 17.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 121.611 -0.68 . . . . 1.0 112.051 -164.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.49 24.37 47.03 Favored Glycine 0 CA--C 1.494 -1.272 0 N-CA-C 117.403 1.721 . . . . 1.0 117.403 159.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.3 mt -103.7 166.88 10.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 124.773 1.229 . . . . 1.0 112.733 -171.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.9 m -101.91 133.19 47.07 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 120.552 -1.342 . . . . 1.0 110.08 171.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 20.5 ptp -66.45 -25.42 66.72 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 115.499 1.666 . . . . 1.0 115.499 -170.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 -87.05 -1.62 58.01 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.281 -1.512 . . . . 1.0 112.783 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -102.82 -4.73 24.47 Favored 'General case' 0 N--CA 1.433 -1.297 0 O-C-N 120.893 -1.129 . . . . 1.0 111.792 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.6 pt -118.95 142.37 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 O-C-N 120.69 -1.256 . . . . 1.0 111.326 175.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -138.16 143.85 40.48 Favored 'General case' 0 N--CA 1.434 -1.268 0 O-C-N 120.246 -1.534 . . . . 1.0 107.542 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -105.65 145.16 31.39 Favored 'General case' 0 N--CA 1.433 -1.318 0 O-C-N 121.102 -0.999 . . . . 1.0 109.346 -175.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -120.84 152.61 38.18 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.462 1.125 . . . . 1.0 109.838 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -127.99 119.23 25.05 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.261 -1.755 . . . . 1.0 106.261 162.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.8 t70 52.68 45.99 27.59 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.075 1.35 . . . . 1.0 113.615 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.73 3.92 87.58 Favored Glycine 0 N--CA 1.435 -1.406 0 N-CA-C 117.823 1.889 . . . . 1.0 117.823 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -121.38 144.63 40.47 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 120.762 2.281 . . . . 1.0 109.039 176.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -68.04 149.65 77.17 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 122.785 2.03 . . . . 1.0 113.701 176.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.9 pt -116.84 141.97 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.258 0 N-CA-C 106.012 -1.847 . . . . 1.0 106.012 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -112.64 171.26 7.63 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 120.481 -1.387 . . . . 1.0 109.842 -162.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -73.53 -16.77 61.27 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.428 -2.045 . . . . 1.0 113.131 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.7 m -83.54 -13.88 53.51 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 125.15 1.38 . . . . 1.0 112.436 167.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -77.36 167.37 21.8 Favored 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.087 -2.258 . . . . 1.0 111.208 168.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.0 p -154.78 160.4 30.95 Favored Pre-proline 0 CA--C 1.496 -1.103 0 O-C-N 120.057 -1.652 . . . . 1.0 109.873 -160.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.1 -41.17 26.91 Favored 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 124.352 3.368 . . . . 1.0 116.328 161.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.09 88.1 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 114.489 1.292 . . . . 1.0 114.489 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -71.42 -38.4 71.4 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.323 1.449 . . . . 1.0 113.014 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 tp -94.57 -1.93 52.43 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 121.088 -1.008 . . . . 1.0 112.905 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 55.29 48.22 19.74 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 126.495 1.918 . . . . 1.0 114.915 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.6 mtt -62.2 144.12 55.89 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 126.136 1.774 . . . . 1.0 113.758 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -92.49 176.33 6.5 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 122.354 1.073 . . . . 1.0 112.473 -174.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.258 9.3 p-10 -56.57 -26.52 55.44 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 127.832 2.453 . . . . 1.0 115.144 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -138.39 75.36 1.52 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 125.185 1.394 . . . . 1.0 108.123 166.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.76 157.22 31.79 Favored 'General case' 0 N--CA 1.436 -1.145 0 O-C-N 119.668 -1.895 . . . . 1.0 113.696 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.9 m -125.62 115.25 19.84 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.905 0.86 . . . . 1.0 110.314 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.3 mm -122.02 140.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.172 0 C-N-CA 127.548 2.339 . . . . 1.0 108.747 -172.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -110.91 147.02 35.52 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.855 -1.778 . . . . 1.0 109.578 -163.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 59.8 t -108.53 129.33 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.22 0 O-C-N 121.002 -1.062 . . . . 1.0 109.865 -175.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -118.71 138.88 52.33 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 122.97 1.367 . . . . 1.0 110.701 163.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -87.19 142.37 27.96 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 121.15 -0.969 . . . . 1.0 112.764 -175.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.433 -1.315 0 O-C-N 121.199 -0.938 . . . . 1.0 110.785 -169.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . 0.738 HG11 HG22 ' A' ' 30' ' ' VAL . 31.1 t . . . . . 0 N--CA 1.436 -1.173 0 CA-C-O 122.035 0.922 . . . . 1.0 113.199 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . 0.46 HG13 HG12 ' B' ' 966' ' ' VAL . 1.2 mt -94.41 123.94 46.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 O-C-N 121.053 -1.029 . . . . 1.0 108.501 -159.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -101.98 107.1 18.13 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.183 -1.573 . . . . 1.0 107.033 172.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.461 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.3 pp . . . . . 0 N--CA 1.437 -1.077 0 O-C-N 120.219 -1.55 . . . . 1.0 112.824 -172.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.43 -1.432 0 CA-C-O 122.45 1.119 . . . . 1.0 113.098 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.6 pt -136.37 160.63 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 C-N-CA 128.53 2.732 . . . . 1.0 106.343 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -117.66 144.7 44.96 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 119.641 -1.912 . . . . 1.0 106.589 169.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.47 154.55 51.35 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.392 -1.443 . . . . 1.0 107.142 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -120.0 148.23 43.81 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.071 1.748 . . . . 1.0 111.354 175.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 t -119.98 122.93 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 N-CA-C 107.783 -1.192 . . . . 1.0 107.783 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.57 130.17 55.01 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 124.615 1.166 . . . . 1.0 111.883 -172.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.294 0 CA-C-O 122.746 1.192 . . . . 1.0 114.756 -177.658 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.436 -1.16 0 N-CA-C 113.421 0.897 . . . . 1.0 113.421 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -129.26 138.73 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.862 -1.774 . . . . 1.0 110.169 169.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.69 145.88 47.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-O 124.06 1.885 . . . . 1.0 113.77 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.83 141.7 44.73 Favored 'General case' 0 N--CA 1.432 -1.353 0 O-C-N 119.81 -1.806 . . . . 1.0 109.254 -166.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.272 26.7 ttpt -107.05 115.89 30.97 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.552 1.941 . . . . 1.0 113.483 -176.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.52 ' HB ' HD11 ' B' ' 969' ' ' LEU . 6.8 tt -148.86 154.62 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.429 0 CA-C-O 123.994 1.854 . . . . 1.0 109.833 -158.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.305 3.7 mppt? -95.89 165.76 12.12 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.316 -1.765 . . . . 1.0 112.48 -172.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.4 mtm180 -63.49 -38.07 89.72 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 115.847 1.795 . . . . 1.0 115.847 -160.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -85.43 -23.97 27.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.549 -1.344 . . . . 1.0 112.742 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.8 m -59.12 131.79 87.29 Favored Pre-proline 0 N--CA 1.436 -1.148 0 C-N-CA 126.972 2.109 . . . . 1.0 115.062 -169.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.02 162.05 41.61 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 124.097 3.198 . . . . 1.0 115.236 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.384 2.7 pp -66.91 -25.69 66.5 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 124.663 1.185 . . . . 1.0 114.178 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.4 p -52.74 -29.17 25.63 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 120.342 -1.474 . . . . 1.0 114.839 170.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.73 -43.53 65.69 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.212 -1.555 . . . . 1.0 112.32 -172.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.445 HD13 ' H ' ' A' ' 43' ' ' LEU 0.359 0.0 OUTLIER -68.09 -31.13 70.53 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.61 -1.306 . . . . 1.0 114.167 168.624 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 9.7 ttt -61.64 -43.43 98.88 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.535 -1.353 . . . . 1.0 114.001 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -67.47 -36.41 81.1 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 120.41 -1.431 . . . . 1.0 113.554 170.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.51 -34.89 77.78 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 119.411 -2.056 . . . . 1.0 114.323 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.6 -43.06 99.56 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 126.296 1.839 . . . . 1.0 111.914 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 75.4 m -61.51 -43.85 98.13 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.614 -1.304 . . . . 1.0 113.834 171.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -62.35 -51.84 66.02 Favored 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 120.6 -1.313 . . . . 1.0 114.442 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.444 ' HB2' HD11 ' B' ' 967' ' ' ILE . 0.0 OUTLIER -78.47 -43.33 27.39 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 115.132 1.53 . . . . 1.0 115.132 -176.82 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -108.77 4.22 23.43 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 121.206 -0.933 . . . . 1.0 111.448 -166.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.01 4.95 89.74 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 117.896 1.919 . . . . 1.0 117.896 161.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.7 mt -76.63 160.95 28.96 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.742 1.617 . . . . 1.0 113.833 -173.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 m -102.27 131.77 48.63 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 120.426 -1.421 . . . . 1.0 109.138 168.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.9 ptp -66.58 -18.54 65.42 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 116.427 2.01 . . . . 1.0 116.427 -173.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -85.61 -8.92 57.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 120.602 -1.312 . . . . 1.0 114.078 173.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -82.07 -33.25 29.96 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.634 -1.916 . . . . 1.0 112.453 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.6 pt -113.59 152.68 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 C-N-CA 125.279 1.431 . . . . 1.0 111.119 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -137.69 154.92 49.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 O-C-N 120.511 -1.368 . . . . 1.0 108.055 172.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 -111.3 148.56 32.66 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.662 1.22 . . . . 1.0 110.553 -173.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 53.3 mtm180 -130.26 159.28 37.36 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 122.165 0.983 . . . . 1.0 109.454 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -133.8 125.71 29.05 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 163.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 48.35 44.79 20.35 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 126.816 2.046 . . . . 1.0 114.416 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.98 6.83 86.32 Favored Glycine 0 N--CA 1.435 -1.424 0 O-C-N 120.146 -1.596 . . . . 1.0 116.785 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -119.94 148.28 46.27 Favored Pre-proline 0 N--CA 1.436 -1.13 0 CA-C-N 121.14 2.47 . . . . 1.0 109.288 175.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.11 149.72 52.73 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 122.588 2.192 . . . . 1.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.1 pt -120.57 140.41 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 N-CA-C 107.166 -1.42 . . . . 1.0 107.166 174.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.51 164.28 11.75 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.759 -1.213 . . . . 1.0 110.957 -168.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.9 -13.89 60.59 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 119.056 -2.277 . . . . 1.0 113.945 -176.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 m -96.7 1.45 51.01 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 124.6 1.16 . . . . 1.0 111.226 170.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -82.5 172.0 13.5 Favored 'General case' 0 N--CA 1.432 -1.325 0 O-C-N 119.098 -2.251 . . . . 1.0 110.211 171.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.5 p -147.98 162.19 32.02 Favored Pre-proline 0 CA--C 1.498 -1.053 0 O-C-N 119.684 -1.885 . . . . 1.0 112.384 -153.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -56.17 -33.62 90.95 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 123.587 2.858 . . . . 1.0 115.879 166.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.88 -45.96 69.63 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 119.573 1.078 . . . . 1.0 113.541 176.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.26 -38.64 71.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 125.638 1.575 . . . . 1.0 113.63 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -93.27 -8.47 42.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 121.014 -1.053 . . . . 1.0 111.669 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 63.87 43.22 5.51 Favored 'General case' 0 N--CA 1.435 -1.219 0 C-N-CA 126.878 2.071 . . . . 1.0 113.763 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.2 147.0 49.18 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.216 1.807 . . . . 1.0 111.825 175.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -120.41 176.33 5.54 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 108.712 -0.847 . . . . 1.0 108.712 -168.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.276 10.7 p-10 -54.79 -26.54 35.32 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.837 2.055 . . . . 1.0 115.272 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.07 77.19 1.69 Allowed 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.582 1.553 . . . . 1.0 110.073 166.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.69 160.91 22.29 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 119.656 -1.903 . . . . 1.0 114.823 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -133.59 115.57 14.85 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 124.808 1.243 . . . . 1.0 111.059 -178.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.6 mm -120.4 140.72 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.027 0 C-N-CA 127.817 2.447 . . . . 1.0 111.049 -171.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -110.86 137.41 48.55 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.92 -1.738 . . . . 1.0 109.907 -162.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.65 132.21 57.19 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.246 0 O-C-N 120.774 -1.204 . . . . 1.0 109.63 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -120.4 137.3 54.39 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-O 123.135 1.445 . . . . 1.0 110.223 159.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -96.85 120.4 37.11 Favored 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 120.671 -1.268 . . . . 1.0 110.357 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 . . . . . 0 N--CA 1.434 -1.268 0 O-C-N 121.124 -0.985 . . . . 1.0 111.831 -174.12 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.295 0.2 OUTLIER . . . . . 0 N--CA 1.436 -1.156 0 N-CA-C 115.234 1.568 . . . . 1.0 115.234 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . 0.444 HD11 ' HB2' ' A' ' 50' ' ' ARG . 6.3 mt -113.12 115.42 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 124.113 0.965 . . . . 1.0 109.699 -171.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -102.15 101.98 12.37 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.715 1.606 . . . . 1.0 110.897 172.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.52 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.439 -0.988 0 N-CA-C 118.922 2.934 . . . . 1.0 118.922 -168.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.4 p-80 . . . . . 0 N--CA 1.435 -1.181 0 N-CA-C 117.272 2.323 . . . . 1.0 117.272 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.2 pt -133.26 160.82 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.3 0 C-N-CA 128.732 2.813 . . . . 1.0 107.38 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -110.09 144.92 37.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 O-C-N 118.988 -2.32 . . . . 1.0 108.441 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.71 HD22 HG21 ' A' ' 34' ' ' ILE . 1.5 pt? -127.13 149.79 49.79 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.678 -1.889 . . . . 1.0 106.384 169.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -117.71 148.83 41.64 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 119.74 -1.85 . . . . 1.0 110.629 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.4 t -117.3 127.95 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.271 0 N-CA-C 107.127 -1.434 . . . . 1.0 107.127 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.69 130.13 55.67 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.2 1.0 . . . . 1.0 110.323 176.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.427 0 CA-C-O 123.093 1.385 . . . . 1.0 114.096 178.291 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 N--CA 1.437 -1.108 0 CA-C-O 121.502 0.668 . . . . 1.0 112.611 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.24 138.82 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.947 -1.72 . . . . 1.0 112.174 173.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.45 147.95 34.16 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-O 125.052 2.358 . . . . 1.0 115.488 175.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -132.95 140.62 47.91 Favored 'General case' 0 N--CA 1.432 -1.365 0 O-C-N 119.523 -1.985 . . . . 1.0 107.862 -170.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -104.56 118.96 37.88 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 126.318 1.847 . . . . 1.0 109.368 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.71 HG21 HD22 ' A' ' 20' ' ' LEU . 12.8 tt -148.46 154.81 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.317 0 CA-C-O 125.238 2.447 . . . . 1.0 111.537 -151.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -104.97 160.35 15.1 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 112.844 -1.98 . . . . 1.0 112.201 -176.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -61.74 -38.08 86.64 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 116.198 1.925 . . . . 1.0 116.198 -166.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -98.52 -9.8 24.45 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 119.982 -1.698 . . . . 1.0 113.654 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 88.9 m -62.05 121.68 67.29 Favored Pre-proline 0 N--CA 1.437 -1.101 0 C-N-CA 125.047 1.339 . . . . 1.0 111.402 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.59 160.23 44.53 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 CA-C-N 123.926 2.438 . . . . 1.0 114.309 -168.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.466 1.5 pp -61.45 -25.59 67.32 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 114.914 1.45 . . . . 1.0 114.914 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 99.0 p -52.77 -29.02 24.98 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.206 -1.559 . . . . 1.0 115.165 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.59 -46.98 67.91 Favored 'General case' 0 N--CA 1.437 -1.098 0 O-C-N 120.974 -1.079 . . . . 1.0 111.924 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.408 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -68.64 -31.5 70.69 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.667 -1.271 . . . . 1.0 112.914 174.605 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.6 ttp -59.82 -44.99 93.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.316 -1.49 . . . . 1.0 114.369 175.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -66.33 -38.44 87.68 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.778 -1.201 . . . . 1.0 112.697 174.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.96 -37.96 89.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 114.263 1.209 . . . . 1.0 114.263 174.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.01 -43.27 99.14 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 126.066 1.747 . . . . 1.0 111.902 174.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.3 m -62.17 -44.71 96.0 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.882 -1.136 . . . . 1.0 113.454 174.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -66.3 -49.52 66.78 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 114.17 1.174 . . . . 1.0 114.17 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -71.14 -43.29 67.87 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.04 -1.662 . . . . 1.0 115.285 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -115.32 6.35 14.88 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 121.077 -1.015 . . . . 1.0 112.929 -163.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.02 9.26 84.56 Favored Glycine 0 CA--C 1.493 -1.308 0 N-CA-C 117.153 1.621 . . . . 1.0 117.153 162.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.89 159.63 23.62 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.553 -1.557 . . . . 1.0 112.32 -175.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.3 m -102.33 134.02 46.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 O-C-N 121.1 -1.0 . . . . 1.0 110.146 172.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.7 ptp -66.26 -30.75 71.24 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 115.935 1.828 . . . . 1.0 115.935 -167.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt-85 -78.38 -15.04 59.1 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.348 -1.47 . . . . 1.0 113.455 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -92.07 -12.66 32.48 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.399 1.08 . . . . 1.0 111.756 -174.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -119.71 143.68 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.201 0 C-N-CA 124.34 1.056 . . . . 1.0 109.16 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -137.81 154.94 49.49 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.642 -1.286 . . . . 1.0 108.118 172.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -114.22 140.43 48.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 107.991 -1.115 . . . . 1.0 107.991 -162.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -129.67 149.54 51.38 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 120.822 -1.174 . . . . 1.0 109.191 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -123.53 112.31 17.32 Favored 'General case' 0 N--CA 1.433 -1.301 0 N-CA-C 107.81 -1.182 . . . . 1.0 107.81 160.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.6 t0 56.67 45.15 22.52 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 125.557 1.543 . . . . 1.0 113.974 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.94 1.44 84.88 Favored Glycine 0 N--CA 1.436 -1.309 0 N-CA-C 116.267 1.267 . . . . 1.0 116.267 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.61 125.81 31.87 Favored Pre-proline 0 N--CA 1.435 -1.223 0 CA-C-N 119.243 1.521 . . . . 1.0 108.994 -174.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -54.54 135.28 65.83 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.641 2.894 . . . . 1.0 115.79 169.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.8 pt -119.57 143.01 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -112.25 166.61 11.12 Favored 'General case' 0 CA--C 1.494 -1.2 0 O-C-N 120.407 -1.433 . . . . 1.0 110.995 -164.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -65.74 -21.49 66.52 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 119.825 -1.797 . . . . 1.0 114.755 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.1 m -82.89 -15.57 50.92 Favored 'General case' 0 N--CA 1.437 -1.109 0 C-N-CA 125.147 1.379 . . . . 1.0 112.959 171.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.8 168.75 19.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.217 -2.177 . . . . 1.0 112.637 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.1 p -148.63 158.81 39.65 Favored Pre-proline 0 CA--C 1.497 -1.08 0 O-C-N 120.179 -1.575 . . . . 1.0 110.68 -157.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -59.72 -30.91 93.25 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.18 2.586 . . . . 1.0 115.523 171.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.53 -46.03 74.01 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-O 122.035 0.921 . . . . 1.0 113.434 174.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -71.11 -42.56 69.13 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.717 1.207 . . . . 1.0 113.906 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.54 -8.54 58.88 Favored 'General case' 0 N--CA 1.435 -1.21 0 O-C-N 121.19 -0.944 . . . . 1.0 111.233 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 63.21 48.24 3.76 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 126.584 1.954 . . . . 1.0 112.983 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -64.67 148.55 50.77 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 127.201 2.201 . . . . 1.0 112.997 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -101.52 176.89 5.08 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 124.423 1.089 . . . . 1.0 110.069 -173.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.417 14.0 p-10 -60.48 -26.64 66.95 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 116.689 2.107 . . . . 1.0 116.689 -175.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -135.16 90.94 2.68 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.918 1.287 . . . . 1.0 108.442 157.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.51 163.57 22.59 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.845 -1.159 . . . . 1.0 114.013 -174.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.1 m -130.75 115.24 16.38 Favored 'General case' 0 CA--C 1.496 -1.098 0 O-C-N 121.307 -0.871 . . . . 1.0 110.337 177.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 47.1 mm -120.12 140.72 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 128.395 2.678 . . . . 1.0 109.452 -171.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -110.86 138.32 47.41 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 119.987 -1.696 . . . . 1.0 108.547 -164.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -115.56 133.53 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-O 122.789 1.28 . . . . 1.0 110.169 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -116.18 138.72 51.03 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 125.057 1.343 . . . . 1.0 110.218 169.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -89.11 137.21 32.53 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.884 -1.135 . . . . 1.0 111.874 -173.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 . . . . . 0 N--CA 1.435 -1.212 0 C-N-CA 125.499 1.52 . . . . 1.0 110.5 -178.851 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.277 0.2 OUTLIER . . . . . 0 CA--C 1.494 -1.18 0 N-CA-C 114.504 1.298 . . . . 1.0 114.504 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.2 mt -112.5 118.59 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 N-CA-C 108.39 -0.967 . . . . 1.0 108.39 -173.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -102.14 108.35 19.72 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 119.982 -1.698 . . . . 1.0 108.857 166.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 N--CA 1.437 -1.101 0 O-C-N 119.766 -1.834 . . . . 1.0 113.471 -170.559 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 . . . . . 0 N--CA 1.428 -1.541 0 N-CA-C 115.464 1.653 . . . . 1.0 115.464 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.5 pt -143.02 160.83 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 C-N-CA 130.917 3.687 . . . . 1.0 105.991 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -113.74 144.81 42.34 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 118.21 -2.806 . . . . 1.0 107.55 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.786 HD22 HG21 ' A' ' 34' ' ' ILE . 1.0 OUTLIER -133.8 156.6 47.73 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 119.327 -2.108 . . . . 1.0 105.975 173.801 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.38 150.64 50.65 Favored 'General case' 0 N--CA 1.434 -1.26 0 O-C-N 119.809 -1.807 . . . . 1.0 112.524 171.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.1 t -113.02 129.15 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.921 -1.511 . . . . 1.0 106.921 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 136.37 54.88 Favored 'General case' 0 N--CA 1.433 -1.324 0 C-N-CA 124.504 1.122 . . . . 1.0 112.453 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.494 -1.277 0 O-C-N 121.06 -1.025 . . . . 1.0 114.719 170.416 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t . . . . . 0 N--CA 1.434 -1.235 0 N-CA-C 107.421 -1.326 . . . . 1.0 107.421 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.541 ' CG2' HG11 ' B' ' 966' ' ' VAL . 1.1 p -129.16 138.02 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.101 0 O-C-N 121.325 -0.86 . . . . 1.0 111.204 174.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.41 ' HG3' HG23 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -100.98 160.07 14.68 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.829 3.204 . . . . 1.0 115.821 171.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -141.92 140.65 32.86 Favored 'General case' 0 N--CA 1.427 -1.61 0 O-C-N 118.954 -2.341 . . . . 1.0 105.174 -175.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.3 ttpt -101.39 117.32 34.7 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.336 -1.477 . . . . 1.0 107.618 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.786 HG21 HD22 ' A' ' 20' ' ' LEU . 6.4 tt -138.54 154.83 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-O 123.903 1.811 . . . . 1.0 110.09 -151.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -121.91 159.33 27.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.595 -1.639 . . . . 1.0 111.417 -177.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -71.23 -18.68 62.44 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 117.21 2.3 . . . . 1.0 117.21 -164.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 50.0 m80 -81.75 -28.64 33.22 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.925 -1.734 . . . . 1.0 112.481 167.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.4 m -66.88 116.16 32.45 Favored Pre-proline 0 N--CA 1.437 -1.088 0 N-CA-C 114.654 1.353 . . . . 1.0 114.654 -166.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.42 161.78 44.51 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 123.477 2.785 . . . . 1.0 115.099 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.454 3.0 pp -64.9 -25.63 67.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 114.582 1.327 . . . . 1.0 114.582 -178.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.5 p -52.85 -29.26 27.01 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 115.326 1.602 . . . . 1.0 115.326 167.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.19 -46.82 54.69 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.246 -1.534 . . . . 1.0 111.785 -171.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.761 HD13 ' H ' ' A' ' 43' ' ' LEU 0.337 0.0 OUTLIER -70.18 -31.29 68.69 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 113.995 1.109 . . . . 1.0 113.995 174.21 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.7 ttm -59.74 -45.85 90.95 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.413 -1.429 . . . . 1.0 113.797 170.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -65.15 -38.22 89.91 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.426 -1.421 . . . . 1.0 113.669 171.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.82 82.03 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 119.994 -1.691 . . . . 1.0 114.219 176.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.59 -41.13 94.08 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.695 1.998 . . . . 1.0 110.677 171.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 67.3 m -64.11 -43.51 95.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 120.66 -1.275 . . . . 1.0 113.812 172.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.93 -51.0 62.43 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.384 -1.448 . . . . 1.0 114.295 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -72.63 -43.21 63.53 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.365 -1.459 . . . . 1.0 114.77 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -116.26 12.26 15.34 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 121.799 0.809 . . . . 1.0 112.185 -162.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.38 10.8 85.59 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.411 1.325 . . . . 1.0 116.411 160.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.0 mt -80.48 159.95 25.41 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 124.887 1.275 . . . . 1.0 113.321 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 74.6 m -102.27 130.6 49.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.977 -1.077 . . . . 1.0 110.812 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.7 tpt -59.89 -38.27 81.76 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 116.298 1.962 . . . . 1.0 116.298 -165.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.422 ' NH1' HE22 ' A' ' 57' ' ' GLN . 7.7 ptm180 -94.71 1.68 55.51 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 120.705 -1.247 . . . . 1.0 111.993 -176.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.422 HE22 ' NH1' ' A' ' 56' ' ' ARG . 11.6 mp0 -102.17 -8.37 21.4 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 121.086 -1.008 . . . . 1.0 111.126 175.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 pt -116.83 138.12 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.215 0 O-C-N 120.483 -1.386 . . . . 1.0 109.34 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -138.18 154.96 49.12 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 106.675 -1.602 . . . . 1.0 106.675 173.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -115.88 148.74 39.65 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.994 1.378 . . . . 1.0 111.077 -169.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.8 ptt180 -136.31 150.16 48.76 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 121.083 -1.011 . . . . 1.0 109.57 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -124.74 109.05 12.63 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.166 -1.79 . . . . 1.0 106.166 173.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . 0.435 38.3 m-20 59.67 -127.04 1.18 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-O 116.721 -1.609 . . . . 1.0 110.826 -144.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.25 -16.2 53.35 Favored Glycine 0 CA--C 1.495 -1.158 3 C-N-CA 138.983 7.944 . . . . 1.0 118.565 7.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -123.6 129.47 24.84 Favored Pre-proline 0 N--CA 1.435 -1.19 0 CA-C-N 120.11 1.955 . . . . 1.0 109.142 160.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.26 135.19 66.56 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.703 2.269 . . . . 1.0 113.048 156.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.6 pt -117.64 138.68 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.16 0 CA-C-O 122.142 0.972 . . . . 1.0 108.481 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -112.72 165.99 11.77 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 121.188 -0.945 . . . . 1.0 109.841 -162.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -71.7 -13.83 61.85 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.745 -1.847 . . . . 1.0 113.719 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.5 m -90.23 -7.42 53.56 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 126.295 1.838 . . . . 1.0 111.728 169.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -82.38 165.07 20.61 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 118.387 -2.695 . . . . 1.0 110.661 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.7 p -151.22 164.38 20.44 Favored Pre-proline 0 CA--C 1.498 -1.022 0 O-C-N 120.523 -1.361 . . . . 1.0 110.656 -154.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -60.3 -36.0 89.35 Favored 'Trans proline' 0 N--CA 1.441 -1.599 0 C-N-CA 123.044 2.496 . . . . 1.0 113.999 171.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.18 80.58 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-O 122.57 1.176 . . . . 1.0 112.574 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -68.77 -45.18 72.04 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.453 1.101 . . . . 1.0 113.376 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.8 tp -89.48 -8.4 52.96 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 121.061 -1.024 . . . . 1.0 112.781 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.26 33.0 mt-10 64.35 44.06 4.42 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 127.802 2.441 . . . . 1.0 115.663 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.7 mtt -57.11 154.24 10.31 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 129.17 2.988 . . . . 1.0 113.771 173.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.439 ' HG3' ' H ' ' A' ' 80' ' ' ASP . 13.4 tp10 -142.19 -176.23 4.74 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 106.793 -1.558 . . . . 1.0 106.793 -172.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.439 ' H ' ' HG3' ' A' ' 79' ' ' GLU 0.312 0.9 OUTLIER -53.16 -26.54 17.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.084 2.954 . . . . 1.0 118.628 -165.968 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -140.36 56.36 1.6 Allowed 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 124.784 1.234 . . . . 1.0 110.528 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.45 162.31 25.81 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 119.608 -1.933 . . . . 1.0 116.057 -174.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.2 m -131.72 118.98 20.7 Favored 'General case' 0 CA--C 1.497 -1.088 0 O-C-N 120.968 -1.082 . . . . 1.0 111.795 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.3 mt -119.27 140.7 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 C-N-CA 126.495 1.918 . . . . 1.0 108.995 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.95 137.38 48.65 Favored 'General case' 0 N--CA 1.434 -1.253 0 O-C-N 120.289 -1.507 . . . . 1.0 108.026 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.1 p -108.58 136.75 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.146 0 O-C-N 120.509 -1.369 . . . . 1.0 109.946 -177.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -122.44 143.55 49.61 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.647 -1.283 . . . . 1.0 108.374 171.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -86.96 135.1 33.41 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.129 0.966 . . . . 1.0 112.15 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 . . . . . 0 N--CA 1.432 -1.333 0 C-N-CA 125.397 1.479 . . . . 1.0 109.675 -178.31 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . 0.541 HG11 ' CG2' ' A' ' 30' ' ' VAL . 9.5 t . . . . . 0 N--CA 1.437 -1.084 0 CA-C-O 121.663 0.744 . . . . 1.0 112.468 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . 0.403 ' H ' ' HB ' ' B' ' 966' ' ' VAL . 0.9 OUTLIER -86.51 130.39 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 O-C-N 120.433 -1.417 . . . . 1.0 110.437 -155.263 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -102.17 112.34 24.97 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.918 -1.739 . . . . 1.0 109.981 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 56.2 mt . . . . . 0 N--CA 1.437 -1.115 0 O-C-N 119.011 -2.306 . . . . 1.0 116.108 -174.492 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 68.1 m80 . . . . . 0 N--CA 1.433 -1.298 0 CA-C-O 121.768 0.794 . . . . 1.0 110.844 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.3 pt -143.02 160.84 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 130.488 3.515 . . . . 1.0 104.961 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -109.58 144.79 37.4 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 119.102 -2.249 . . . . 1.0 108.431 166.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.82 HD22 HG21 ' A' ' 34' ' ' ILE . 1.1 pt? -128.2 154.29 45.98 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.425 -2.047 . . . . 1.0 105.792 170.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 0.0 OUTLIER -124.07 150.68 44.7 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.701 -1.874 . . . . 1.0 111.756 169.803 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -110.9 136.78 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 O-C-N 121.166 -0.959 . . . . 1.0 108.64 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.17 130.15 53.58 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 124.494 1.118 . . . . 1.0 111.945 -174.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.381 0 CA-C-O 122.915 1.286 . . . . 1.0 113.999 -177.514 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p . . . . . 0 N--CA 1.434 -1.239 0 N-CA-C 109.077 -0.712 . . . . 1.0 109.077 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.423 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.311 0.3 OUTLIER -129.36 135.86 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.105 0 O-C-N 119.692 -1.88 . . . . 1.0 111.164 166.15 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.417 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -110.13 153.98 23.94 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 124.794 2.235 . . . . 1.0 114.377 175.64 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.5 140.53 37.24 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 106.477 -1.675 . . . . 1.0 106.477 -170.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -99.54 118.08 35.33 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.191 1.796 . . . . 1.0 107.084 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.82 HG21 HD22 ' A' ' 20' ' ' LEU . 8.7 tt -143.84 154.72 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.423 0 C-N-CA 126.595 1.958 . . . . 1.0 109.556 -154.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -116.55 161.16 19.57 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 113.172 -1.831 . . . . 1.0 112.399 -173.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -61.41 -38.02 85.59 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 125.329 1.452 . . . . 1.0 114.707 -164.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -101.08 14.5 31.76 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 124.373 1.069 . . . . 1.0 113.515 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.2 m -86.45 121.48 72.3 Favored Pre-proline 0 CA--C 1.497 -1.065 0 CA-C-O 116.703 -1.618 . . . . 1.0 109.367 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.31 158.95 41.99 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 CA-C-N 125.653 3.055 . . . . 1.0 115.534 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.403 1.3 pp -63.63 -25.57 68.28 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 125.302 1.441 . . . . 1.0 114.404 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -52.72 -29.11 25.05 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.501 -1.374 . . . . 1.0 114.222 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -42.69 68.86 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.442 -1.411 . . . . 1.0 111.524 -176.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.67 -37.14 84.17 Favored 'General case' 0 N--CA 1.434 -1.239 0 O-C-N 120.467 -1.396 . . . . 1.0 113.283 171.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.8 ttm -61.94 -42.63 99.33 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 119.83 -1.794 . . . . 1.0 113.872 175.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -43.57 98.45 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.746 1.26 . . . . 1.0 112.326 175.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.13 89.94 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 125.506 1.522 . . . . 1.0 113.837 177.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -61.03 -42.38 98.36 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 125.626 1.57 . . . . 1.0 111.561 172.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.2 m -63.57 -43.17 97.8 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.915 -1.116 . . . . 1.0 113.528 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.56 -48.78 63.37 Favored 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 124.36 1.064 . . . . 1.0 113.394 177.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -73.6 -43.02 60.76 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 116.537 2.051 . . . . 1.0 116.537 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -112.9 10.15 18.96 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.957 -1.089 . . . . 1.0 111.883 -165.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.0 43.17 10.05 Favored Glycine 0 CA--C 1.494 -1.246 0 N-CA-C 117.869 1.908 . . . . 1.0 117.869 160.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.5 mt -123.3 161.93 23.67 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 121.1 -1.235 . . . . 1.0 110.556 -168.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.8 m -102.23 133.21 47.48 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 120.137 -1.602 . . . . 1.0 111.084 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.5 tpt -58.68 -39.33 80.38 Favored 'General case' 0 N--CA 1.437 -1.112 0 N-CA-C 116.662 2.097 . . . . 1.0 116.662 -167.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -92.57 1.47 57.24 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.565 -1.334 . . . . 1.0 112.588 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -100.14 -21.82 15.41 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 124.486 1.114 . . . . 1.0 112.601 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.8 pt -112.95 149.66 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 124.252 1.021 . . . . 1.0 108.947 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.23 154.99 49.07 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.837 -1.164 . . . . 1.0 109.102 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -115.08 147.28 40.38 Favored 'General case' 0 N--CA 1.434 -1.243 0 O-C-N 120.934 -1.104 . . . . 1.0 110.613 -173.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 58.9 mtm180 -130.94 161.06 32.73 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 121.212 -0.93 . . . . 1.0 110.95 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -131.91 114.52 14.75 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.083 0.468 . . . . 1.0 109.99 164.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 t0 53.79 42.36 31.79 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 127.311 2.244 . . . . 1.0 114.066 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.95 0.78 83.27 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 124.978 1.275 . . . . 1.0 115.761 -176.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -99.9 137.6 20.18 Favored Pre-proline 0 N--CA 1.434 -1.242 0 O-C-N 120.337 -1.684 . . . . 1.0 109.53 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.97 137.66 24.57 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 CA-C-N 122.873 2.062 . . . . 1.0 112.127 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 19.4 pt -118.42 140.52 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.14 0 N-CA-C 106.011 -1.848 . . . . 1.0 106.011 177.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -106.64 161.52 14.57 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.163 -1.585 . . . . 1.0 109.711 -166.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -57.79 -34.97 70.19 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.403 -2.06 . . . . 1.0 115.532 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -78.55 -12.64 60.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.282 1.033 . . . . 1.0 113.145 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -74.04 170.52 15.27 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 119.475 -2.015 . . . . 1.0 111.66 177.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 63.9 p -148.02 162.31 31.51 Favored Pre-proline 0 CA--C 1.499 -0.992 0 O-C-N 119.065 -2.272 . . . . 1.0 112.746 -153.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_exo -55.04 -36.52 92.95 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 124.389 3.393 . . . . 1.0 115.857 163.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.55 -45.6 89.77 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 119.556 1.071 . . . . 1.0 113.639 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.61 -44.97 76.78 Favored 'General case' 0 N--CA 1.432 -1.345 0 C-N-CA 124.706 1.202 . . . . 1.0 112.624 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -90.6 -8.5 49.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 120.527 -1.358 . . . . 1.0 113.15 -176.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 69.48 37.79 1.91 Allowed 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 128.573 2.749 . . . . 1.0 114.675 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 52.5 mtt -58.19 152.76 16.4 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 128.326 2.65 . . . . 1.0 115.593 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.3 178.32 5.42 Favored 'General case' 0 N--CA 1.433 -1.307 0 O-C-N 121.139 -0.976 . . . . 1.0 109.666 -167.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.346 14.3 p-10 -54.38 -26.56 30.92 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 117.246 2.313 . . . . 1.0 117.246 -174.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -136.66 62.03 1.62 Allowed 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.52 1.528 . . . . 1.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.63 166.45 20.71 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 119.203 -2.186 . . . . 1.0 115.21 -177.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.7 m -133.56 121.56 22.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 O-C-N 121.04 -1.037 . . . . 1.0 110.7 -174.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.2 mm -118.67 140.71 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.103 0 C-N-CA 126.954 2.102 . . . . 1.0 109.327 -175.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -110.97 141.73 44.04 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.993 -1.692 . . . . 1.0 109.256 -167.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.1 t -108.49 128.97 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.181 0 CA-C-O 122.41 1.1 . . . . 1.0 109.842 -176.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -116.45 139.67 50.2 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 122.742 1.258 . . . . 1.0 111.159 173.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -96.84 120.32 36.96 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 121.254 -0.904 . . . . 1.0 111.81 -167.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 . . . . . 0 N--CA 1.435 -1.195 0 O-C-N 120.831 -1.168 . . . . 1.0 110.596 174.59 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . 0.423 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.27 0.2 OUTLIER . . . . . 0 N--CA 1.437 -1.114 0 N-CA-C 114.601 1.334 . . . . 1.0 114.601 . . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -108.68 116.57 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 N-CA-C 107.418 -1.327 . . . . 1.0 107.418 -172.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -102.21 110.66 22.68 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.918 -1.739 . . . . 1.0 106.671 167.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.445 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.5 pp . . . . . 0 CA--C 1.498 -1.057 0 O-C-N 120.048 -1.657 . . . . 1.0 113.621 -170.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.435 -1.195 0 N-CA-C 114.526 1.306 . . . . 1.0 114.526 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.2 pt -142.95 160.82 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.299 1 C-N-CA 131.893 4.077 . . . . 1.0 106.096 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -113.89 144.93 42.22 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 117.722 -3.111 . . . . 1.0 110.112 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 HG21 ' A' ' 34' ' ' ILE . 1.0 OUTLIER -129.95 148.51 51.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 119.036 -2.29 . . . . 1.0 107.689 171.207 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 8.6 ptpt -115.03 150.63 35.58 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 119.478 -2.014 . . . . 1.0 111.63 169.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.8 p -119.59 131.57 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 O-C-N 121.062 -1.023 . . . . 1.0 108.822 175.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.62 130.25 51.26 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 122.791 1.281 . . . . 1.0 112.654 -175.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.429 0 CA-C-O 123.328 1.516 . . . . 1.0 115.572 -177.614 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.437 -1.125 0 CA-C-O 121.71 0.767 . . . . 1.0 112.031 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -129.21 138.74 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 O-C-N 119.722 -1.861 . . . . 1.0 110.842 167.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -113.68 146.4 39.87 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-O 124.688 2.185 . . . . 1.0 114.138 176.103 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.54 140.62 49.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.827 -1.796 . . . . 1.0 107.591 -170.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -100.34 116.54 32.55 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 125.231 1.412 . . . . 1.0 109.491 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.693 HG21 HD22 ' A' ' 20' ' ' LEU . 11.3 tt -141.73 154.85 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.39 0 C-N-CA 128.167 2.587 . . . . 1.0 110.11 -152.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.55 164.28 14.54 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 112.974 -1.921 . . . . 1.0 112.448 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -67.28 -38.07 84.47 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 115.081 1.512 . . . . 1.0 115.081 -165.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -98.11 31.09 2.84 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 124.861 1.264 . . . . 1.0 112.08 174.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.4 m -114.65 111.68 45.99 Favored Pre-proline 0 N--CA 1.436 -1.153 0 O-C-N 120.585 -1.322 . . . . 1.0 107.596 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -62.04 160.17 31.18 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 123.98 3.12 . . . . 1.0 116.432 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.378 2.0 pp -63.89 -25.65 68.25 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 122.941 1.353 . . . . 1.0 114.15 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 t -52.51 -29.21 23.95 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 125.289 1.435 . . . . 1.0 113.896 169.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -66.75 -44.04 82.52 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.124 -1.61 . . . . 1.0 112.876 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.08 -32.2 70.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.493 -1.379 . . . . 1.0 113.101 174.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.0 ttm -60.59 -44.43 96.26 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 120.277 -1.514 . . . . 1.0 114.175 173.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -66.15 -38.25 87.67 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.566 -1.333 . . . . 1.0 113.339 172.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.93 85.31 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 120.179 -1.575 . . . . 1.0 114.048 175.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -62.55 -41.6 99.0 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 125.846 1.658 . . . . 1.0 112.257 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.5 -44.02 97.4 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 125.467 1.507 . . . . 1.0 113.014 171.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -64.9 -50.01 68.21 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.32 -1.487 . . . . 1.0 114.101 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -77.04 -43.34 34.92 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 115.345 1.609 . . . . 1.0 115.345 -177.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -113.44 -0.45 14.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.899 -1.125 . . . . 1.0 112.013 -165.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 2.69 89.15 Favored Glycine 0 CA--C 1.493 -1.283 0 N-CA-C 117.713 1.845 . . . . 1.0 117.713 164.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.45 153.21 37.74 Favored 'General case' 0 N--CA 1.433 -1.31 0 O-C-N 120.856 -1.379 . . . . 1.0 111.993 -170.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.2 m -99.32 127.73 45.37 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 120.724 -1.235 . . . . 1.0 109.442 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.6 ptp -66.53 -20.79 66.11 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.036 -1.665 . . . . 1.0 115.133 -174.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptt85 -75.75 -11.07 59.92 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 124.57 1.148 . . . . 1.0 114.019 170.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -109.38 -8.37 15.07 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.336 -1.477 . . . . 1.0 113.594 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.1 pt -128.49 150.19 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.16 0 O-C-N 120.128 -1.607 . . . . 1.0 109.99 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.24 150.0 46.29 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 107.959 -1.126 . . . . 1.0 107.959 170.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -108.38 144.58 35.76 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 121.206 -0.934 . . . . 1.0 109.676 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -134.13 159.1 41.9 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 122.48 1.133 . . . . 1.0 111.24 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -139.1 123.55 18.29 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 108.048 -1.094 . . . . 1.0 108.048 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 56.27 38.39 29.74 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 126.211 1.804 . . . . 1.0 113.351 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.28 2.73 84.42 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 116.287 1.275 . . . . 1.0 116.287 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -116.13 140.62 26.6 Favored Pre-proline 0 N--CA 1.435 -1.196 0 CA-C-N 120.094 1.947 . . . . 1.0 109.642 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -48.82 135.3 28.5 Favored 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 124.155 3.237 . . . . 1.0 117.245 169.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 pt -117.93 138.19 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.242 0 N-CA-C 106.329 -1.73 . . . . 1.0 106.329 169.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -104.12 167.14 9.95 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 121.096 -1.003 . . . . 1.0 109.887 -162.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -78.14 -16.54 57.85 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.032 -2.293 . . . . 1.0 111.259 -176.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.21 -13.83 59.45 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 130.959 3.703 . . . . 1.0 113.607 167.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -86.08 169.61 12.99 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 119.639 -1.913 . . . . 1.0 111.361 171.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.2 p -151.51 161.15 30.47 Favored Pre-proline 0 CA--C 1.496 -1.1 0 O-C-N 120.201 -1.562 . . . . 1.0 110.612 -158.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -58.42 -31.56 94.34 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 C-N-CA 123.846 3.031 . . . . 1.0 115.32 167.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.44 -46.07 74.2 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 119.544 1.065 . . . . 1.0 113.033 172.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -69.31 -37.73 77.91 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 124.499 1.12 . . . . 1.0 113.755 -176.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -95.18 -0.63 53.03 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 120.807 -1.183 . . . . 1.0 111.86 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 56.15 42.61 28.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 127.541 2.336 . . . . 1.0 115.86 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.8 mtt -59.84 149.42 31.41 Favored 'General case' 0 N--CA 1.434 -1.275 0 C-N-CA 127.126 2.17 . . . . 1.0 113.748 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -109.67 -172.38 2.03 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 121.358 -0.839 . . . . 1.0 109.113 -165.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.363 14.0 p-10 -60.21 -26.47 66.42 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.045 -1.659 . . . . 1.0 115.119 176.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -143.61 87.51 1.94 Allowed 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 124.416 1.087 . . . . 1.0 110.426 170.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.44 169.29 11.19 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 114.794 1.405 . . . . 1.0 114.794 178.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.3 m -136.45 123.13 21.06 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 124.874 1.269 . . . . 1.0 109.822 -175.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.8 mm -121.47 140.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 126.297 1.839 . . . . 1.0 108.883 -175.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -110.91 141.76 43.9 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.049 -1.657 . . . . 1.0 108.891 -171.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -108.59 139.63 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.142 0 O-C-N 120.522 -1.361 . . . . 1.0 109.542 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -124.45 137.46 54.44 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 122.206 1.003 . . . . 1.0 108.959 167.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -81.88 133.3 35.31 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.355 1.062 . . . . 1.0 112.228 -174.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 . . . . . 0 N--CA 1.435 -1.206 0 C-N-CA 124.972 1.309 . . . . 1.0 111.029 -174.985 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.272 0.2 OUTLIER . . . . . 0 CA--C 1.495 -1.137 0 N-CA-C 115.145 1.535 . . . . 1.0 115.145 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.1 mt -110.53 123.88 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 C-N-CA 124.218 1.007 . . . . 1.0 108.97 -170.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -102.14 105.63 16.36 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.52 -1.362 . . . . 1.0 108.294 165.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.9 pp . . . . . 0 N--CA 1.436 -1.171 0 O-C-N 120.624 -1.297 . . . . 1.0 113.022 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.435 -1.197 0 N-CA-C 116.295 1.961 . . . . 1.0 116.295 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.4 pt -138.06 160.78 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 129.132 2.973 . . . . 1.0 105.316 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -111.75 144.9 40.27 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.252 -2.155 . . . . 1.0 108.832 177.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.613 HD22 HG21 ' A' ' 34' ' ' ILE . 1.3 pt? -129.43 156.13 44.59 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 119.474 -2.016 . . . . 1.0 106.331 170.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.58 150.58 45.77 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 119.433 -2.042 . . . . 1.0 111.453 166.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 p -118.27 137.95 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 N-CA-C 108.377 -0.972 . . . . 1.0 108.377 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.88 130.2 49.71 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 121.356 -0.84 . . . . 1.0 112.498 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.364 0 CA-C-O 122.333 0.963 . . . . 1.0 114.587 -178.621 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 N--CA 1.434 -1.243 0 CA-C-O 121.89 0.852 . . . . 1.0 108.853 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.292 0.3 OUTLIER -129.42 138.75 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 O-C-N 120.4 -1.437 . . . . 1.0 111.717 173.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.06 149.91 39.52 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 124.058 1.885 . . . . 1.0 115.022 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.49 140.58 31.91 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.534 -1.354 . . . . 1.0 108.974 -162.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -104.22 115.84 31.12 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 125.283 1.433 . . . . 1.0 113.172 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.613 HG21 HD22 ' A' ' 20' ' ' LEU . 13.5 tt -141.32 154.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-O 124.614 2.15 . . . . 1.0 111.576 -154.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -93.7 153.98 18.05 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 112.272 -2.24 . . . . 1.0 113.504 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 68.9 mtt-85 -69.8 -38.17 76.55 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 115.783 1.772 . . . . 1.0 115.783 -172.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -101.43 33.99 2.74 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.29 -1.506 . . . . 1.0 112.367 -174.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.32 155.11 80.54 Favored Pre-proline 0 CA--C 1.496 -1.114 0 O-C-N 120.601 -1.312 . . . . 1.0 108.119 -173.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -78.12 149.85 25.69 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 CA-C-N 124.241 2.55 . . . . 1.0 114.351 -167.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.336 2.1 pp -61.02 -25.53 66.98 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 125.876 1.67 . . . . 1.0 114.512 172.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 92.3 p -52.7 -29.04 24.54 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 119.366 -2.083 . . . . 1.0 113.823 171.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -65.33 -40.88 94.27 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.632 -1.293 . . . . 1.0 112.74 -174.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.9 -37.73 84.93 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.609 -1.307 . . . . 1.0 113.686 167.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 54.7 ttm -60.81 -42.12 97.04 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.097 -1.627 . . . . 1.0 113.908 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.83 -43.33 99.09 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.909 -1.119 . . . . 1.0 112.395 174.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.41 83.82 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.528 -1.358 . . . . 1.0 114.477 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -60.2 -42.76 95.76 Favored 'General case' 0 N--CA 1.436 -1.161 0 C-N-CA 125.959 1.704 . . . . 1.0 112.033 174.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.4 m -62.15 -41.65 98.49 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 124.793 1.237 . . . . 1.0 113.791 176.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.99 -47.29 75.04 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 114.289 1.218 . . . . 1.0 114.289 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -75.86 -42.99 47.81 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 116.185 1.92 . . . . 1.0 116.185 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -114.07 11.89 17.78 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.868 -1.145 . . . . 1.0 112.551 -161.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.34 43.71 19.43 Favored Glycine 0 CA--C 1.494 -1.244 0 N-CA-C 117.078 1.591 . . . . 1.0 117.078 164.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.4 mt -124.63 156.5 37.4 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 124.334 1.054 . . . . 1.0 111.154 -169.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.5 m -102.2 131.35 48.79 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.543 -1.348 . . . . 1.0 111.01 170.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -65.02 -24.5 67.52 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 116.317 1.969 . . . . 1.0 116.317 -170.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -89.69 -3.46 58.21 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.258 -1.526 . . . . 1.0 112.848 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -100.87 -15.91 17.42 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.715 -1.241 . . . . 1.0 111.849 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.2 pt -114.42 147.09 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 C-N-CA 125.312 1.445 . . . . 1.0 108.322 174.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -137.75 152.22 48.98 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.154 -1.424 . . . . 1.0 107.154 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.8 m-30 -109.4 148.59 30.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-O 123.079 1.418 . . . . 1.0 109.956 -173.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -139.62 140.97 37.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 108.023 -1.103 . . . . 1.0 108.023 -168.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -127.01 115.96 20.02 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.12 -1.437 . . . . 1.0 107.12 171.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t70 59.16 40.11 22.14 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 125.48 1.512 . . . . 1.0 114.117 171.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.71 5.17 90.15 Favored Glycine 0 N--CA 1.438 -1.216 0 N-CA-C 116.173 1.229 . . . . 1.0 116.173 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -117.17 136.67 23.45 Favored Pre-proline 0 N--CA 1.433 -1.278 0 O-C-N 120.291 -1.711 . . . . 1.0 109.97 -173.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -58.51 137.46 80.44 Favored 'Trans proline' 0 N--CA 1.44 -1.631 0 C-N-CA 123.539 2.826 . . . . 1.0 114.558 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.0 pt -117.13 135.68 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 N-CA-C 106.206 -1.776 . . . . 1.0 106.206 171.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -100.59 163.9 12.14 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.363 -1.461 . . . . 1.0 110.232 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.87 -17.55 61.52 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 119.053 -2.279 . . . . 1.0 113.598 -178.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 98.9 m -78.6 -19.78 51.96 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 125.665 1.586 . . . . 1.0 112.53 167.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -76.61 170.7 15.93 Favored 'General case' 0 N--CA 1.432 -1.355 0 O-C-N 119.702 -1.874 . . . . 1.0 112.153 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 77.2 p -149.25 159.07 37.7 Favored Pre-proline 0 CA--C 1.495 -1.154 0 O-C-N 119.861 -1.775 . . . . 1.0 109.556 -158.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -58.04 -35.05 99.04 Favored 'Trans proline' 0 N--CA 1.439 -1.69 0 C-N-CA 123.334 2.689 . . . . 1.0 114.94 168.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.97 83.26 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 113.916 1.08 . . . . 1.0 113.916 176.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -68.94 -42.52 76.62 Favored 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 124.845 1.258 . . . . 1.0 113.56 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -86.01 -8.47 57.93 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 121.926 0.87 . . . . 1.0 111.073 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 66.7 44.35 2.21 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 127.196 2.199 . . . . 1.0 114.259 175.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 60.3 mtt -62.05 154.24 27.38 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 128.598 2.759 . . . . 1.0 113.398 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -113.3 178.23 4.35 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 107.981 -1.118 . . . . 1.0 107.981 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.459 10.2 p-10 -54.23 -26.5 28.9 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 117.164 2.283 . . . . 1.0 117.164 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -138.28 58.5 1.67 Allowed 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 125.887 1.675 . . . . 1.0 112.069 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.89 161.61 29.59 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 116.233 1.938 . . . . 1.0 116.233 -171.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 61.2 m -129.04 116.42 19.28 Favored 'General case' 0 CA--C 1.497 -1.065 0 C-N-CA 125.011 1.325 . . . . 1.0 111.971 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.7 mm -120.74 140.91 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 C-N-CA 127.974 2.51 . . . . 1.0 109.842 -170.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -110.93 143.86 40.91 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 119.528 -1.983 . . . . 1.0 108.918 -167.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.4 t -108.66 126.25 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.214 0 O-C-N 120.955 -1.091 . . . . 1.0 108.762 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -113.6 134.84 54.48 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 123.403 1.573 . . . . 1.0 107.543 172.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -106.33 124.65 49.92 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.923 -1.111 . . . . 1.0 110.751 -161.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 . . . . . 0 N--CA 1.436 -1.157 0 O-C-N 120.777 -1.202 . . . . 1.0 112.597 -174.646 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.495 -1.17 0 N-CA-C 115.285 1.587 . . . . 1.0 115.285 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.4 mt -113.08 119.01 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 C-N-CA 125.11 1.364 . . . . 1.0 110.18 -173.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -102.02 115.65 31.0 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.06 -1.65 . . . . 1.0 106.808 165.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.497 -1.072 0 CA-C-N 121.667 2.031 . . . . 1.0 114.581 -174.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 . . . . . 0 N--CA 1.436 -1.129 0 N-CA-C 117.141 2.274 . . . . 1.0 117.141 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.3 pt -129.57 160.66 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 129.346 3.058 . . . . 1.0 106.153 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.75 144.79 44.98 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.925 -2.985 . . . . 1.0 111.027 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.65 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -131.52 151.38 51.63 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.286 -2.134 . . . . 1.0 107.992 170.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 7.5 ptpt -121.38 150.61 41.23 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 119.908 -1.745 . . . . 1.0 110.697 172.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.52 131.9 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 N-CA-C 108.314 -0.995 . . . . 1.0 108.314 174.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.75 132.43 54.61 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 124.759 1.224 . . . . 1.0 111.027 -174.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.49 0 N-CA-C 109.236 -1.546 . . . . 1.0 109.236 176.793 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.436 -1.143 0 N-CA-C 109.501 -0.555 . . . . 1.0 109.501 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.401 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.292 0.3 OUTLIER -129.31 138.72 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 O-C-N 119.846 -1.784 . . . . 1.0 111.208 166.4 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.407 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -116.31 147.21 41.77 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-O 125.393 2.521 . . . . 1.0 114.425 176.921 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -127.23 140.58 52.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.331 -1.729 . . . . 1.0 106.331 -173.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -101.23 115.85 31.44 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.835 2.454 . . . . 1.0 107.164 176.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.65 HG21 HD22 ' A' ' 20' ' ' LEU . 9.6 tt -137.7 154.72 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 CA-C-O 125.57 2.605 . . . . 1.0 109.362 -155.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 mtpp -108.74 164.16 12.62 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 110.967 -2.833 . . . . 1.0 111.775 -165.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -59.41 -38.01 79.53 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.989 1.848 . . . . 1.0 115.989 -160.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 -116.65 33.73 5.43 Favored 'General case' 0 N--CA 1.432 -1.35 0 O-C-N 120.958 -1.089 . . . . 1.0 111.759 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.8 m -90.77 124.85 61.1 Favored Pre-proline 0 N--CA 1.438 -1.072 0 O-C-N 120.654 -1.279 . . . . 1.0 109.938 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.73 159.82 52.02 Favored 'Trans proline' 0 N--CA 1.441 -1.615 0 C-N-CA 122.988 2.459 . . . . 1.0 114.615 175.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.359 1.0 OUTLIER -64.99 -25.79 68.01 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 114.805 1.409 . . . . 1.0 114.805 179.841 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.8 p -52.77 -29.24 26.18 Favored 'General case' 0 N--CA 1.437 -1.108 0 O-C-N 120.097 -1.627 . . . . 1.0 115.379 168.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.04 -42.9 68.9 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.042 -1.661 . . . . 1.0 112.572 -175.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.429 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -65.77 -35.68 81.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.67 -1.269 . . . . 1.0 113.527 172.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.9 ttm -61.75 -43.1 99.51 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 120.233 -1.542 . . . . 1.0 113.771 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -42.75 99.3 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 120.926 -1.108 . . . . 1.0 112.969 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.2 86.79 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.515 1.126 . . . . 1.0 113.759 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.38 -42.59 98.96 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.574 1.55 . . . . 1.0 112.212 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.2 m -61.88 -43.69 98.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.528 1.131 . . . . 1.0 113.525 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.58 -48.66 68.89 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.667 1.358 . . . . 1.0 114.667 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.1 -43.18 62.1 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 119.886 -1.759 . . . . 1.0 115.558 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -113.58 8.95 17.85 Favored 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 121.129 -0.982 . . . . 1.0 112.389 -165.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.63 9.84 85.11 Favored Glycine 0 CA--C 1.494 -1.267 0 N-CA-C 116.815 1.486 . . . . 1.0 116.815 162.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.7 mt -81.61 166.34 20.29 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 125.323 1.449 . . . . 1.0 113.238 -174.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -102.21 139.64 37.56 Favored 'General case' 0 CA--C 1.494 -1.21 0 O-C-N 120.563 -1.336 . . . . 1.0 112.245 170.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -29.25 70.63 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.1 1.36 . . . . 1.0 113.484 -178.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.6 ptt180 -95.0 -6.94 41.15 Favored 'General case' 0 N--CA 1.433 -1.291 0 C-N-CA 124.185 0.994 . . . . 1.0 112.771 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -94.6 -22.53 18.12 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.185 -1.572 . . . . 1.0 111.065 174.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 18.9 pt -110.2 145.03 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 CA-C-O 121.475 0.655 . . . . 1.0 112.368 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -138.17 154.95 49.13 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.403 -1.436 . . . . 1.0 109.176 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -115.41 148.67 39.08 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.502 -1.373 . . . . 1.0 112.803 -169.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.75 151.82 48.52 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 126.686 1.994 . . . . 1.0 109.133 175.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -130.84 116.19 17.6 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 108.797 -0.816 . . . . 1.0 108.797 167.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 37.5 t0 55.08 44.07 28.62 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 125.385 1.474 . . . . 1.0 113.31 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.79 2.43 81.36 Favored Glycine 0 N--CA 1.437 -1.288 0 O-C-N 120.314 -1.491 . . . . 1.0 115.924 -177.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -108.93 128.78 24.85 Favored Pre-proline 0 N--CA 1.435 -1.194 0 O-C-N 120.498 -1.59 . . . . 1.0 109.779 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -53.06 135.3 58.73 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 123.469 2.779 . . . . 1.0 116.435 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 pt -119.98 141.4 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.249 -1.389 . . . . 1.0 107.249 174.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.76 160.46 16.71 Favored 'General case' 0 N--CA 1.435 -1.224 0 O-C-N 120.727 -1.233 . . . . 1.0 109.182 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.77 -30.07 70.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 119.82 -1.8 . . . . 1.0 114.14 -173.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.1 m -96.58 6.25 49.1 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.36 1.464 . . . . 1.0 112.489 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -71.2 178.84 3.11 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 118.411 -2.68 . . . . 1.0 113.205 173.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.0 p -120.79 151.96 55.32 Favored Pre-proline 0 CA--C 1.498 -1.019 0 O-C-N 120.151 -1.593 . . . . 1.0 113.557 -161.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -56.4 -30.83 83.14 Favored 'Trans proline' 0 N--CA 1.442 -1.5 0 C-N-CA 123.806 3.004 . . . . 1.0 116.637 170.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.99 87.97 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 114.141 1.163 . . . . 1.0 114.141 173.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.21 -36.76 82.37 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 126.414 1.886 . . . . 1.0 112.793 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.657 HD11 HD12 ' A' ' 84' ' ' ILE . 62.3 tp -81.6 -8.49 59.72 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-O 122.795 1.283 . . . . 1.0 111.399 178.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 56.58 48.26 16.93 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 127.048 2.139 . . . . 1.0 113.376 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 93.7 mtp -62.19 143.48 56.72 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 115.73 1.752 . . . . 1.0 115.73 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -148.57 179.65 7.65 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 106.103 -1.814 . . . . 1.0 106.103 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.284 2.2 p30 -54.86 -26.57 36.38 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 116.655 2.094 . . . . 1.0 116.655 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -135.19 105.19 6.2 Favored 'General case' 0 N--CA 1.436 -1.166 0 C-N-CA 125.446 1.498 . . . . 1.0 108.219 162.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.439 ' HB3' ' HB2' ' A' ' 20' ' ' LEU . 5.0 t0 -100.18 158.73 15.65 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.714 -1.241 . . . . 1.0 112.135 164.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.4 m -136.35 115.29 12.25 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 124.251 1.02 . . . . 1.0 110.57 -176.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.657 HD12 HD11 ' A' ' 76' ' ' LEU . 10.0 mm -120.32 140.81 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.962 2.505 . . . . 1.0 109.219 -166.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -110.79 142.27 43.0 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 119.072 -2.268 . . . . 1.0 108.425 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.7 p -120.38 136.71 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.172 0 C-N-CA 125.114 1.366 . . . . 1.0 109.305 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -133.74 145.13 49.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 124.438 1.095 . . . . 1.0 108.067 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -105.83 132.59 51.76 Favored 'General case' 0 N--CA 1.433 -1.278 0 O-C-N 120.551 -1.343 . . . . 1.0 113.28 -169.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 . . . . . 0 N--CA 1.435 -1.193 0 C-N-CA 124.974 1.31 . . . . 1.0 112.755 -173.752 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . 0.401 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.333 0.2 OUTLIER . . . . . 0 N--CA 1.434 -1.25 0 N-CA-C 116.143 1.905 . . . . 1.0 116.143 . . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -112.37 113.47 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 O-C-N 121.51 -0.743 . . . . 1.0 109.495 -168.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.04 122.45 44.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.662 -1.899 . . . . 1.0 109.667 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 66.8 mt . . . . . 0 N--CA 1.437 -1.096 0 N-CA-C 115.748 1.758 . . . . 1.0 115.748 -172.099 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 . . . . . 0 N--CA 1.432 -1.357 0 CA-C-O 121.946 0.879 . . . . 1.0 108.957 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.6 pt -138.19 160.72 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 C-N-CA 129.975 3.31 . . . . 1.0 106.198 -171.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -117.89 144.89 45.04 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 119.353 -2.092 . . . . 1.0 110.712 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.685 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -134.03 160.83 36.56 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 118.761 -2.462 . . . . 1.0 108.334 173.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -131.7 150.66 52.08 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 119.985 -1.697 . . . . 1.0 112.914 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.477 HG22 ' HB ' ' A' ' 84' ' ' ILE . 47.0 t -119.12 119.28 60.35 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 N-CA-C 107.407 -1.331 . . . . 1.0 107.407 176.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -113.55 130.14 56.42 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.79 0.805 . . . . 1.0 111.918 -170.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.502 0 CA-C-O 122.948 1.305 . . . . 1.0 115.32 -175.141 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.9 p . . . . . 0 N--CA 1.434 -1.237 0 N-CA-C 110.176 -0.305 . . . . 1.0 110.176 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.72 HG22 HG11 ' B' ' 966' ' ' VAL . 0.9 OUTLIER -119.23 138.74 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.119 0 O-C-N 120.868 -1.145 . . . . 1.0 108.983 174.13 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.435 ' H ' HG21 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -112.68 160.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 126.729 3.157 . . . . 1.0 114.42 179.934 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.437 ' HB2' HD23 ' A' ' 20' ' ' LEU . 8.3 m-85 -145.1 140.64 28.18 Favored 'General case' 0 N--CA 1.428 -1.548 0 O-C-N 118.838 -2.414 . . . . 1.0 107.883 -165.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.277 30.0 ttpt -104.98 115.89 31.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.315 2.246 . . . . 1.0 113.994 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.685 HG21 HD22 ' A' ' 20' ' ' LEU . 6.3 tt -142.67 154.67 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.356 0 CA-C-O 124.007 1.86 . . . . 1.0 110.612 -154.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.266 3.7 mppt? -107.19 165.79 11.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 113.843 -1.526 . . . . 1.0 113.668 -175.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -63.28 -38.05 89.66 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 -160.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -99.14 -4.07 33.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.607 -1.308 . . . . 1.0 112.498 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 m -60.45 134.41 91.34 Favored Pre-proline 0 N--CA 1.437 -1.123 0 C-N-CA 126.294 1.838 . . . . 1.0 113.576 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.73 160.73 37.47 Favored 'Trans proline' 0 N--CA 1.441 -1.6 0 C-N-CA 122.867 2.378 . . . . 1.0 113.712 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.375 1.0 OUTLIER -65.58 -25.56 67.46 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 126.101 1.76 . . . . 1.0 114.066 178.613 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.2 p -52.8 -29.02 25.21 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 115.822 1.786 . . . . 1.0 115.822 173.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -65.39 -43.79 89.58 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 119.962 1.256 . . . . 1.0 114.079 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.545 HD22 HD21 ' A' ' 20' ' ' LEU . 0.5 OUTLIER -69.69 -31.06 68.88 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.052 -1.655 . . . . 1.0 112.693 177.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 tpp -60.43 -43.57 96.66 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 120.703 -1.248 . . . . 1.0 113.7 171.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -61.57 -43.35 99.03 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.696 -1.252 . . . . 1.0 113.381 171.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.38 -34.04 73.94 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.739 -1.85 . . . . 1.0 114.147 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.4 -36.88 79.15 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 127.217 2.207 . . . . 1.0 111.56 170.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 53' ' ' LEU . 77.7 m -69.9 -30.76 68.26 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 127.454 2.302 . . . . 1.0 113.671 170.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -67.07 -52.65 39.45 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 119.12 -2.237 . . . . 1.0 113.386 165.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -78.92 -43.44 24.75 Favored 'General case' 0 N--CA 1.437 -1.117 1 N-CA-C 125.339 5.311 . . . . 1.0 125.339 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -160.98 -18.03 0.05 Allowed 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 119.955 3.317 . . . . 1.0 119.955 -157.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.27 -37.56 4.29 Favored Glycine 0 CA--C 1.492 -1.375 0 O-C-N 118.55 -2.594 . . . . 1.0 110.83 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.461 ' HA ' ' HA ' ' A' ' 48' ' ' CYS 0.884 0.1 OUTLIER 57.16 -28.49 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.397 2 N-CA-C 128.003 6.297 . . . . 1.0 128.003 161.769 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.8 m -102.4 123.65 46.55 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 105.94 -1.874 . . . . 1.0 105.94 154.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -63.76 -18.52 64.15 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.689 -1.257 . . . . 1.0 112.564 169.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -90.86 -3.52 57.3 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 113.307 0.855 . . . . 1.0 113.307 174.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -82.07 -38.54 24.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 120.009 -1.682 . . . . 1.0 112.527 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.6 pp -128.03 141.95 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.125 0 O-C-N 121.295 -0.878 . . . . 1.0 112.959 -165.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 155.06 48.98 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.549 1.539 . . . . 1.0 108.738 174.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -106.13 144.96 32.1 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.677 -1.264 . . . . 1.0 112.578 -168.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -126.39 145.18 50.56 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 126.284 1.834 . . . . 1.0 112.771 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -116.38 111.74 20.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.657 1.183 . . . . 1.0 108.549 168.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 t70 48.06 50.39 16.06 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 126.72 2.008 . . . . 1.0 114.574 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.73 0.89 89.9 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 117.544 1.778 . . . . 1.0 117.544 -178.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -118.3 133.46 23.49 Favored Pre-proline 0 N--CA 1.435 -1.206 0 CA-C-N 120.549 2.175 . . . . 1.0 110.528 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_exo -48.0 135.22 23.87 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 124.424 3.416 . . . . 1.0 117.55 168.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.6 pt -116.58 154.97 18.13 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 C-N-CA 124.826 1.251 . . . . 1.0 107.849 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -103.33 160.49 14.64 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.927 -1.108 . . . . 1.0 110.096 -175.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -63.18 -28.2 69.89 Favored 'General case' 0 CA--C 1.496 -1.106 0 O-C-N 119.554 -1.966 . . . . 1.0 114.04 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.3 m -92.29 -0.26 57.41 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 120.98 -1.075 . . . . 1.0 112.022 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -67.84 174.59 3.55 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.489 -2.007 . . . . 1.0 113.54 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.6 p -111.01 150.52 42.03 Favored Pre-proline 0 N--CA 1.438 -1.069 0 O-C-N 120.275 -1.515 . . . . 1.0 112.32 -156.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -58.01 -32.98 96.66 Favored 'Trans proline' 0 N--CA 1.44 -1.62 0 C-N-CA 122.959 2.439 . . . . 1.0 115.585 170.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.79 -45.37 82.65 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -66.66 -34.36 77.69 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.755 1.622 . . . . 1.0 113.595 -177.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 42.3 tp -95.33 -5.15 44.12 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.951 1.701 . . . . 1.0 112.023 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 59.47 45.33 13.71 Favored 'General case' 0 N--CA 1.436 -1.131 0 C-N-CA 127.468 2.307 . . . . 1.0 114.817 175.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.0 mtp -65.76 135.96 55.6 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 116.503 2.038 . . . . 1.0 116.503 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -150.48 -173.77 4.56 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.66 1.584 . . . . 1.0 108.516 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -55.77 -26.72 47.25 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 118.157 2.651 . . . . 1.0 118.157 -172.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -141.49 83.15 1.85 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.747 1.219 . . . . 1.0 108.311 167.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -85.59 159.6 19.83 Favored 'General case' 0 CA--C 1.498 -1.058 0 O-C-N 120.667 -1.271 . . . . 1.0 112.538 175.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -127.59 128.2 45.16 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 124.481 1.112 . . . . 1.0 109.843 174.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.477 ' HB ' HG22 ' A' ' 22' ' ' VAL . 77.1 mt -118.31 140.78 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 129.256 3.022 . . . . 1.0 106.605 178.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -110.75 145.51 37.96 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 119.526 -1.984 . . . . 1.0 105.893 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -108.56 139.73 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.302 0 O-C-N 120.721 -1.237 . . . . 1.0 108.215 -171.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -119.3 135.26 54.79 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-O 123.054 1.407 . . . . 1.0 108.673 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 62.4 tp60 -81.99 120.58 25.43 Favored 'General case' 0 N--CA 1.432 -1.336 0 C-N-CA 125.344 1.458 . . . . 1.0 110.148 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 . . . . . 0 N--CA 1.433 -1.311 0 O-C-N 121.295 -0.878 . . . . 1.0 110.847 179.156 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . 0.72 HG11 HG22 ' A' ' 30' ' ' VAL . 28.4 t . . . . . 0 N--CA 1.435 -1.202 0 CA-C-O 122.103 0.954 . . . . 1.0 111.943 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . 0.415 ' N ' HG12 ' B' ' 966' ' ' VAL . 0.4 OUTLIER -95.44 132.04 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 O-C-N 120.803 -1.185 . . . . 1.0 111.892 -157.092 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -102.0 107.95 19.24 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 125.509 1.524 . . . . 1.0 108.397 173.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.589 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.5 OUTLIER . . . . . 0 CA--C 1.494 -1.2 0 O-C-N 119.741 -1.849 . . . . 1.0 114.85 -176.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.0 p-80 . . . . . 0 N--CA 1.43 -1.449 0 N-CA-C 117.475 2.398 . . . . 1.0 117.475 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -132.68 160.73 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 C-N-CA 130.98 3.712 . . . . 1.0 105.096 173.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -112.25 144.77 41.1 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.285 -2.135 . . . . 1.0 109.757 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -137.43 160.44 39.1 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.263 -2.148 . . . . 1.0 105.854 177.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -138.05 150.68 47.14 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 119.556 -1.965 . . . . 1.0 111.416 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.429 HG22 ' CE1' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -108.77 132.82 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.612 0 C-N-CA 125.781 1.632 . . . . 1.0 108.21 174.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.36 130.15 56.33 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 123.976 0.91 . . . . 1.0 109.419 173.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.391 0 CA-C-O 122.566 1.092 . . . . 1.0 114.992 -176.521 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.4 p . . . . . 0 N--CA 1.436 -1.156 0 CA-C-O 121.188 0.518 . . . . 1.0 112.231 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.658 HG22 HG11 ' B' ' 966' ' ' VAL 0.26 0.7 OUTLIER -129.24 138.78 53.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 O-C-N 120.056 -1.653 . . . . 1.0 111.616 166.897 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.1 161.6 14.61 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 126.629 3.109 . . . . 1.0 115.686 173.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.429 ' CE1' HG22 ' A' ' 22' ' ' VAL . 3.6 m-85 -145.11 157.65 44.04 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.255 -2.778 . . . . 1.0 107.139 -173.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.268 24.1 ttpt -120.52 115.85 24.25 Favored 'General case' 0 N--CA 1.434 -1.238 0 C-N-CA 124.813 1.245 . . . . 1.0 109.686 -176.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 18.6 tt -148.56 154.74 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 CA-C-O 125.121 2.391 . . . . 1.0 112.028 -162.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.49 163.29 14.69 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 111.476 -2.602 . . . . 1.0 111.741 -177.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 71.0 mtt85 -71.29 -37.97 71.82 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 116.441 2.015 . . . . 1.0 116.441 -164.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -98.73 -11.51 21.85 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.581 -1.325 . . . . 1.0 112.33 -175.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.4 m -59.66 137.1 89.82 Favored Pre-proline 0 N--CA 1.435 -1.192 0 C-N-CA 126.291 1.836 . . . . 1.0 112.73 170.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -71.36 155.25 60.51 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 123.642 2.336 . . . . 1.0 114.994 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.399 2.0 pp -62.01 -25.57 67.73 Favored 'General case' 0 N--CA 1.434 -1.273 0 C-N-CA 125.539 1.535 . . . . 1.0 114.67 174.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.0 p -52.64 -29.11 24.46 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.281 -2.137 . . . . 1.0 114.86 170.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.82 -41.73 87.01 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 119.97 -1.707 . . . . 1.0 112.605 -174.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -37.28 84.96 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.78 -1.2 . . . . 1.0 113.85 170.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.0 ttm -60.2 -42.55 95.35 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 120.243 -1.536 . . . . 1.0 113.771 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.96 -43.62 98.47 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.539 -1.351 . . . . 1.0 112.497 172.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.73 -35.12 79.37 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 114.753 1.39 . . . . 1.0 114.753 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.55 -43.81 89.43 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 127.355 2.262 . . . . 1.0 111.767 174.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.8 m -62.25 -42.36 99.26 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 124.907 1.283 . . . . 1.0 113.531 173.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.09 -46.99 72.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 115.054 1.501 . . . . 1.0 115.054 176.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.465 ' HB2' HD11 ' B' ' 967' ' ' ILE . 2.8 mtt180 -75.6 -43.2 49.34 Favored 'General case' 0 CA--C 1.495 -1.136 0 O-C-N 120.276 -1.515 . . . . 1.0 114.722 178.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -114.98 8.93 15.94 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.12 0.785 . . . . 1.0 113.12 -162.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.14 9.47 86.07 Favored Glycine 0 N--CA 1.437 -1.285 0 N-CA-C 117.355 1.702 . . . . 1.0 117.355 161.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -85.82 162.77 18.5 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 121.321 -1.105 . . . . 1.0 113.446 -174.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.9 m -102.32 129.41 48.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 124.307 1.043 . . . . 1.0 110.307 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -66.54 -22.52 66.16 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 116.47 2.026 . . . . 1.0 116.47 -171.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -90.47 -1.59 57.9 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.317 -1.489 . . . . 1.0 112.759 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -100.49 -10.37 21.16 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.775 -1.203 . . . . 1.0 111.644 177.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -122.92 146.58 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 O-C-N 120.581 -1.324 . . . . 1.0 110.03 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -138.24 154.97 49.06 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.698 -1.223 . . . . 1.0 107.698 171.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -113.97 148.61 36.6 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.655 1.217 . . . . 1.0 110.74 -173.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -137.41 156.89 47.66 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.642 -1.286 . . . . 1.0 108.429 173.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -131.85 113.87 14.0 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 120.987 -1.071 . . . . 1.0 108.522 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 27.0 t0 53.5 46.52 26.0 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 125.534 1.534 . . . . 1.0 113.473 -177.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.65 5.78 86.42 Favored Glycine 0 N--CA 1.436 -1.32 0 O-C-N 120.209 -1.557 . . . . 1.0 116.838 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -119.12 133.14 23.73 Favored Pre-proline 0 N--CA 1.436 -1.136 0 CA-C-N 119.589 1.695 . . . . 1.0 110.137 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -73.43 142.24 32.89 Favored 'Trans proline' 0 C--N 1.308 -1.583 0 CA-C-N 124.173 2.526 . . . . 1.0 113.147 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.0 pt -120.13 145.43 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 C-N-CA 124.931 1.292 . . . . 1.0 109.968 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -109.8 162.89 14.03 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.568 -1.332 . . . . 1.0 111.001 -165.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -70.87 -13.93 62.21 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.738 -1.851 . . . . 1.0 112.796 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -83.07 -14.88 52.89 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 126.874 2.07 . . . . 1.0 112.656 169.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.87 172.24 11.56 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.744 -1.848 . . . . 1.0 111.634 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 82.7 p -147.18 157.25 46.2 Favored Pre-proline 0 CA--C 1.496 -1.097 0 O-C-N 119.962 -1.711 . . . . 1.0 110.202 -162.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -59.85 -32.53 95.49 Favored 'Trans proline' 0 N--CA 1.439 -1.685 0 C-N-CA 123.259 2.639 . . . . 1.0 115.17 170.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.59 -46.05 84.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 113.477 0.918 . . . . 1.0 113.477 175.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -68.22 -39.08 82.46 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.026 1.73 . . . . 1.0 113.355 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 17.4 tp -85.03 -8.47 58.69 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-O 121.809 0.814 . . . . 1.0 113.128 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 64.41 42.47 5.13 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 128.421 2.688 . . . . 1.0 114.996 174.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.73 154.37 39.64 Favored 'General case' 0 N--CA 1.432 -1.328 0 C-N-CA 127.836 2.454 . . . . 1.0 114.29 176.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -126.76 -175.32 3.37 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.488 -1.301 . . . . 1.0 107.488 -168.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.315 8.6 p-10 -56.51 -26.48 54.72 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 117.014 2.227 . . . . 1.0 117.014 -172.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -137.64 92.46 2.69 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 118.503 0.592 . . . . 1.0 111.682 162.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.72 164.8 11.69 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.833 -1.792 . . . . 1.0 115.119 174.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -126.65 120.08 28.61 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 122.52 1.153 . . . . 1.0 112.52 -173.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mt -105.7 140.73 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 C-N-CA 128.772 2.829 . . . . 1.0 109.078 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -110.92 136.08 50.47 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.305 -1.497 . . . . 1.0 107.97 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 36.5 t -115.17 138.93 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 O-C-N 120.96 -1.088 . . . . 1.0 109.546 -171.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -128.03 140.13 52.14 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-O 122.101 0.953 . . . . 1.0 110.391 172.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -90.24 126.69 35.92 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.269 1.028 . . . . 1.0 111.471 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 . . . . . 0 N--CA 1.434 -1.262 0 N-CA-C 116.178 1.918 . . . . 1.0 116.178 -167.382 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . 0.658 HG11 HG22 ' A' ' 30' ' ' VAL . 34.2 t . . . . . 0 N--CA 1.435 -1.206 0 CA-C-O 121.621 0.724 . . . . 1.0 109.959 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . 0.465 HD11 ' HB2' ' A' ' 50' ' ' ARG . 0.9 OUTLIER -90.83 130.61 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 O-C-N 120.881 -1.137 . . . . 1.0 111.37 -155.068 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -102.07 121.9 43.08 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.177 -1.577 . . . . 1.0 111.663 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.435 -1.197 0 O-C-N 120.734 -1.228 . . . . 1.0 112.704 177.027 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m80 . . . . . 0 N--CA 1.435 -1.189 0 N-CA-C 115.123 1.527 . . . . 1.0 115.123 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.404 ' HB ' ' HA ' ' A' ' 80' ' ' ASP . 19.9 pt -134.54 160.7 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 C-N-CA 129.489 3.115 . . . . 1.0 105.045 174.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -117.8 144.74 45.08 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 119.286 -2.134 . . . . 1.0 109.717 175.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.97 157.51 43.89 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 119.531 -1.98 . . . . 1.0 108.495 166.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -119.02 150.62 39.65 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-O 122.795 1.283 . . . . 1.0 113.274 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.32 133.08 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 107.567 -1.272 . . . . 1.0 107.567 173.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -142.82 140.57 31.36 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.796 1.284 . . . . 1.0 114.371 -163.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.32 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.739 174.316 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 N--CA 1.434 -1.228 0 N-CA-C 107.82 -1.178 . . . . 1.0 107.82 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.416 HG22 ' CD1' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -129.14 135.02 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 119.681 -1.887 . . . . 1.0 108.535 161.478 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.71 145.04 26.16 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 123.298 1.523 . . . . 1.0 112.785 159.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.66 ' CE2' HD21 ' B' ' 969' ' ' LEU . 0.0 OUTLIER -138.92 140.61 38.39 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.946 -1.096 . . . . 1.0 108.747 -164.634 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.681 ' O ' HD23 ' B' ' 969' ' ' LEU 0.431 31.3 ttpt -113.48 115.29 27.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.896 1.808 . . . . 1.0 111.798 -169.579 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.8 tp -142.68 154.86 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.484 0 CA-C-N 110.935 -2.848 . . . . 1.0 111.799 -153.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.254 9.2 mtpt -86.68 154.7 20.79 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 112.098 -2.319 . . . . 1.0 112.676 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -71.06 -18.05 62.58 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 117.756 2.502 . . . . 1.0 117.756 -151.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -99.65 -49.93 4.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 119.799 -1.813 . . . . 1.0 111.719 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.6 m -34.0 132.24 0.39 Allowed Pre-proline 0 N--CA 1.439 -1.023 0 C-N-CA 131.286 3.834 . . . . 1.0 118.819 -176.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -45.34 152.41 0.77 Allowed 'Trans proline' 0 N--CA 1.443 -1.456 2 N-CA-C 125.464 5.14 . . . . 1.0 125.464 -165.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -71.18 -25.77 62.68 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 157.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . 0.273 80.9 p -57.67 -29.07 64.32 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.73 -1.856 . . . . 1.0 114.089 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -62.16 -42.56 99.38 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.765 1.226 . . . . 1.0 111.075 174.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -42.9 82.82 Favored 'General case' 0 CA--C 1.491 -1.315 0 C-N-CA 127.639 2.376 . . . . 1.0 112.459 176.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.7 ttt -56.84 -43.07 80.75 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -65.74 -41.81 91.71 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.897 -1.127 . . . . 1.0 113.274 172.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.8 -38.71 91.76 Favored 'General case' 0 N--CA 1.435 -1.188 0 C-N-CA 124.68 1.192 . . . . 1.0 113.922 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.416 ' CD1' HG22 ' A' ' 30' ' ' VAL . 3.2 t80 -60.22 -43.2 96.2 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.802 2.041 . . . . 1.0 112.036 171.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.5 m -64.41 -43.05 95.62 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.355 -1.465 . . . . 1.0 114.182 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -65.08 -48.2 74.55 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.468 -1.395 . . . . 1.0 114.283 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -75.33 -43.22 51.86 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 115.505 1.669 . . . . 1.0 115.505 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -114.53 8.36 16.4 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 121.084 -1.01 . . . . 1.0 112.049 -163.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.88 3.43 90.53 Favored Glycine 0 CA--C 1.493 -1.288 0 N-CA-C 117.439 1.735 . . . . 1.0 117.439 159.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.55 155.27 40.23 Favored 'General case' 0 N--CA 1.434 -1.236 0 C-N-CA 125.741 1.616 . . . . 1.0 113.386 -174.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.9 m -102.19 124.93 48.64 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 120.378 -1.451 . . . . 1.0 109.144 175.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.2 ptm -60.95 -29.15 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.019 2.229 . . . . 1.0 117.019 -170.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.99 -15.54 60.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.16 -1.588 . . . . 1.0 114.218 176.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -97.32 -9.61 27.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.564 1.546 . . . . 1.0 112.287 -175.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.0 pt -120.88 143.99 31.27 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 C-N-CA 124.248 1.019 . . . . 1.0 109.597 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -135.92 154.92 50.97 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -113.93 148.54 36.66 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.484 -1.385 . . . . 1.0 109.745 -172.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -137.66 159.41 42.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 123.116 1.436 . . . . 1.0 111.927 177.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -133.25 117.42 17.36 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.177 -1.828 . . . . 1.0 107.992 170.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.7 t70 59.29 31.66 21.34 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 127.312 2.245 . . . . 1.0 113.238 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.48 2.7 88.17 Favored Glycine 0 N--CA 1.435 -1.393 0 O-C-N 119.955 -1.716 . . . . 1.0 114.646 -176.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -102.12 137.06 19.37 Favored Pre-proline 0 N--CA 1.435 -1.214 0 O-C-N 120.161 -1.788 . . . . 1.0 110.076 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -49.09 135.28 30.23 Favored 'Trans proline' 0 N--CA 1.442 -1.553 0 C-N-CA 124.547 3.498 . . . . 1.0 117.832 170.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 pt -121.89 142.49 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 108.244 -1.021 . . . . 1.0 108.244 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -97.65 167.61 10.86 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 121.143 -0.973 . . . . 1.0 110.922 -175.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -67.63 -19.92 65.28 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.444 -1.41 . . . . 1.0 112.684 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.6 m -99.43 2.0 44.69 Favored 'General case' 0 N--CA 1.436 -1.175 0 C-N-CA 126.764 2.026 . . . . 1.0 111.687 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -80.6 169.07 18.13 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 119.028 -2.295 . . . . 1.0 112.24 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.0 p -106.7 153.04 40.94 Favored Pre-proline 0 N--CA 1.438 -1.027 0 O-C-N 120.905 -1.122 . . . . 1.0 113.481 -157.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.05 -31.35 92.82 Favored 'Trans proline' 0 N--CA 1.44 -1.625 0 C-N-CA 123.374 2.716 . . . . 1.0 116.582 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.35 -45.83 78.84 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 114.029 1.122 . . . . 1.0 114.029 174.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.02 -41.3 82.36 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 125.661 1.584 . . . . 1.0 112.622 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 27.7 tp -87.19 -4.03 59.09 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 124.269 1.027 . . . . 1.0 111.601 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 56.85 44.42 23.29 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 126.554 1.942 . . . . 1.0 113.396 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 91.0 mtp -65.98 143.29 57.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.98 2.112 . . . . 1.0 115.148 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -157.56 179.58 9.1 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 105.837 -1.912 . . . . 1.0 105.837 -171.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.404 ' HA ' ' HB ' ' A' ' 18' ' ' ILE 0.3 6.7 p-10 -51.3 -26.52 7.58 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 128.511 2.724 . . . . 1.0 118.239 -178.279 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -137.78 67.45 1.42 Allowed 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 125.106 1.362 . . . . 1.0 110.638 173.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -78.38 162.68 26.26 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 119.342 -2.098 . . . . 1.0 114.409 179.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.6 m -135.39 123.64 23.12 Favored 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.36 1.064 . . . . 1.0 111.053 178.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 78.8 mt -108.0 140.54 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 C-N-CA 126.371 1.869 . . . . 1.0 108.841 174.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -110.97 140.12 45.74 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.612 -1.305 . . . . 1.0 108.562 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.6 t -108.53 139.07 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 O-C-N 120.559 -1.338 . . . . 1.0 109.959 -169.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -124.67 142.63 51.25 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 122.468 1.127 . . . . 1.0 110.059 173.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.7 pm0 -81.84 140.22 34.27 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.065 1.346 . . . . 1.0 111.851 -178.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.434 -1.251 0 O-C-N 120.618 -1.301 . . . . 1.0 109.971 -172.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 2.1 p . . . . . 0 CA--C 1.495 -1.172 0 CA-C-O 122.801 1.286 . . . . 1.0 111.301 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 3.6 mt -113.13 120.32 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 C-N-CA 125.092 1.357 . . . . 1.0 109.719 162.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.0 140.29 36.49 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 105.032 -2.21 . . . . 1.0 105.032 164.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 33' ' ' LYS . 4.0 mm? . . . . . 0 N--CA 1.438 -1.053 0 CA-C-N 122.668 2.485 . . . . 1.0 116.754 -175.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.435 -1.196 0 N-CA-C 116.005 1.854 . . . . 1.0 116.005 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.9 pt -143.04 160.75 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 C-N-CA 128.368 2.667 . . . . 1.0 107.545 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -117.66 144.85 44.83 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.143 -2.223 . . . . 1.0 108.422 174.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.692 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -127.19 150.56 49.47 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 119.835 -1.791 . . . . 1.0 107.541 173.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.9 ptpt -115.31 148.94 38.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 119.667 -1.895 . . . . 1.0 110.883 171.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.4 t -119.45 123.52 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.54 -1.652 . . . . 1.0 106.54 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.03 130.1 53.64 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.639 1.209 . . . . 1.0 112.188 -173.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.572 0 CA-C-O 122.928 1.293 . . . . 1.0 113.561 177.708 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.434 -1.244 0 N-CA-C 109.942 -0.392 . . . . 1.0 109.942 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.265 0.6 OUTLIER -129.15 138.76 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 O-C-N 119.888 -1.757 . . . . 1.0 110.571 166.477 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.401 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -118.13 149.21 41.43 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-O 124.199 1.952 . . . . 1.0 113.807 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.44 140.71 37.41 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.724 -1.86 . . . . 1.0 107.771 -162.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -103.88 115.87 31.24 Favored 'General case' 0 CA--C 1.493 -1.232 0 C-N-CA 126.304 1.842 . . . . 1.0 111.697 -175.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.692 HG21 HD22 ' A' ' 20' ' ' LEU . 11.0 tt -143.04 154.77 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.388 0 CA-C-O 124.917 2.294 . . . . 1.0 109.943 -152.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -115.03 153.6 30.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 111.716 -2.493 . . . . 1.0 110.26 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.01 -38.08 89.74 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 115.916 1.821 . . . . 1.0 115.916 -158.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -87.06 10.01 17.91 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.916 -1.115 . . . . 1.0 113.945 175.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.4 m -91.8 121.77 66.53 Favored Pre-proline 0 N--CA 1.437 -1.105 0 O-C-N 119.409 -2.057 . . . . 1.0 108.265 177.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.08 158.2 49.19 Favored 'Trans proline' 0 N--CA 1.441 -1.617 0 C-N-CA 123.13 2.554 . . . . 1.0 115.569 -175.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.448 1.5 pp -63.23 -25.66 68.43 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 115.183 1.549 . . . . 1.0 115.183 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.6 p -52.68 -29.06 24.49 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 120.37 -1.456 . . . . 1.0 114.469 170.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.24 -43.13 71.21 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 119.819 -1.801 . . . . 1.0 112.923 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.09 69.7 Favored 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 120.452 -1.405 . . . . 1.0 113.376 172.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.51 -43.53 98.7 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.433 -1.417 . . . . 1.0 113.289 174.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -42.57 98.6 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.686 -1.259 . . . . 1.0 113.596 170.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.23 86.76 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.21 -43.74 95.71 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 126.005 1.722 . . . . 1.0 111.695 175.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.5 m -62.5 -42.58 99.59 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.86 1.264 . . . . 1.0 114.077 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -64.57 -46.22 83.69 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 120.206 -1.558 . . . . 1.0 114.382 174.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -78.38 -43.2 28.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 116.078 1.881 . . . . 1.0 116.078 -178.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.0 mm100 -113.64 4.98 16.31 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 121.509 -0.744 . . . . 1.0 111.84 -166.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.38 84.1 Favored Glycine 0 CA--C 1.494 -1.251 0 N-CA-C 118.655 2.222 . . . . 1.0 118.655 161.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.5 mt -85.02 164.67 18.11 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 121.187 -1.184 . . . . 1.0 113.841 -172.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.9 m -102.2 135.68 43.37 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.394 -1.441 . . . . 1.0 110.709 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.2 mtp -61.82 -38.71 89.18 Favored 'General case' 0 CA--C 1.495 -1.153 0 C-N-CA 125.887 1.675 . . . . 1.0 114.308 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 ptt-85 -92.67 0.73 57.47 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 125.098 1.359 . . . . 1.0 112.751 -175.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mm-40 -92.73 -24.52 18.56 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.61 -1.306 . . . . 1.0 111.002 175.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.1 pt -120.35 149.34 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 O-C-N 120.972 -1.08 . . . . 1.0 110.82 -174.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -134.41 154.97 51.09 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 107.872 -1.159 . . . . 1.0 107.872 168.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -106.51 148.6 28.02 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 -175.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -142.26 155.36 45.23 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 114.834 1.42 . . . . 1.0 114.834 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -115.19 107.45 15.31 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 106.948 -1.501 . . . . 1.0 106.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.2 t70 52.71 33.32 13.66 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 114.84 1.422 . . . . 1.0 114.84 175.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.49 5.78 89.16 Favored Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 118.755 2.262 . . . . 1.0 118.755 -177.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -123.63 152.83 66.0 Favored Pre-proline 0 N--CA 1.436 -1.145 0 CA-C-O 111.748 -3.977 . . . . 1.0 103.887 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.786 57.9 Cg_exo 71.97 155.76 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.827 2 C-N-CA 111.555 -5.163 . . . . 1.0 116.871 169.535 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.295 5.9 pt -123.91 159.24 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 1 C-N-CA 135.01 5.324 . . . . 1.0 111.136 17.769 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -102.82 163.02 12.46 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 120.816 1.644 . . . . 1.0 110.62 172.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.98 -34.63 75.08 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 119.102 -2.248 . . . . 1.0 115.257 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.4 m -92.03 8.53 37.28 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.5 1.12 . . . . 1.0 111.882 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -81.8 172.74 13.0 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.302 -2.124 . . . . 1.0 108.88 163.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 47.7 p -147.03 159.69 42.17 Favored Pre-proline 0 CA--C 1.498 -1.056 0 O-C-N 119.186 -2.196 . . . . 1.0 111.985 -163.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -59.4 -32.17 96.07 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.602 2.868 . . . . 1.0 115.674 168.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.38 -46.08 81.52 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 119.293 0.951 . . . . 1.0 113.154 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -69.22 -41.39 77.1 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 125.507 1.523 . . . . 1.0 113.605 -177.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -79.94 -8.41 59.31 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.661 -1.275 . . . . 1.0 112.805 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.12 46.87 7.72 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 126.124 1.77 . . . . 1.0 113.753 -178.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.0 mtt -62.26 153.78 29.64 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 126.767 2.027 . . . . 1.0 114.047 173.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.59 -179.9 3.93 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.172 0.989 . . . . 1.0 109.277 -171.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -57.3 -26.6 61.13 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 127.155 2.182 . . . . 1.0 116.007 -175.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -136.54 91.37 2.65 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 107.785 -1.191 . . . . 1.0 107.785 161.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.42 161.43 19.43 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.97 -1.706 . . . . 1.0 112.418 173.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.3 m -130.17 115.3 16.82 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 122.224 1.012 . . . . 1.0 110.742 -177.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 140.68 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 126.841 2.056 . . . . 1.0 108.363 -172.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -110.97 151.35 28.04 Favored 'General case' 0 N--CA 1.433 -1.279 0 O-C-N 120.008 -1.682 . . . . 1.0 110.272 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.0 t -108.66 139.56 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 O-C-N 121.026 -1.046 . . . . 1.0 110.29 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -132.43 139.78 48.16 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-O 122.102 0.953 . . . . 1.0 110.036 165.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -87.85 141.21 28.77 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 124.476 1.11 . . . . 1.0 111.482 -175.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 . . . . . 0 N--CA 1.434 -1.242 0 C-N-CA 124.641 1.176 . . . . 1.0 113.101 -177.296 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER . . . . . 0 N--CA 1.436 -1.148 0 N-CA-C 114.728 1.381 . . . . 1.0 114.728 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -107.82 120.13 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.21 0 N-CA-C 107.094 -1.447 . . . . 1.0 107.094 -172.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -102.17 116.9 33.63 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.204 -1.56 . . . . 1.0 107.14 164.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.496 -1.108 0 CA-C-N 120.346 1.43 . . . . 1.0 114.851 -175.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.6 p80 . . . . . 0 N--CA 1.434 -1.227 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.7 pt -135.25 160.65 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 131.213 3.805 . . . . 1.0 106.847 -175.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -113.86 144.9 42.26 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 118.818 -2.426 . . . . 1.0 110.832 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.33 157.62 46.36 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.476 -2.64 . . . . 1.0 105.687 175.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -119.99 150.66 40.17 Favored 'General case' 0 N--CA 1.434 -1.226 0 C-N-CA 127.32 2.248 . . . . 1.0 112.654 171.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.83 132.37 54.32 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.188 0 N-CA-C 106.242 -1.762 . . . . 1.0 106.242 169.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.66 130.15 56.18 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 121.467 0.651 . . . . 1.0 109.479 169.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.372 0 C-N-CA 124.774 1.178 . . . . 1.0 114.69 -176.966 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.436 -1.156 0 CA-C-O 121.933 0.873 . . . . 1.0 111.398 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.824 HG22 HG11 ' B' ' 966' ' ' VAL . 0.6 OUTLIER -129.14 138.71 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.243 -1.536 . . . . 1.0 107.852 168.279 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.528 ' H ' HG21 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -114.8 158.06 22.4 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 126.538 3.066 . . . . 1.0 113.49 172.504 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.474 ' CE1' ' CG1' ' A' ' 30' ' ' VAL 0.271 25.6 m-85 -145.11 148.23 33.41 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 118.218 -2.801 . . . . 1.0 109.214 -159.575 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -116.51 115.7 26.26 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 120.496 1.498 . . . . 1.0 112.965 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 20.9 tt -150.9 154.75 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 125.665 2.65 . . . . 1.0 111.538 -164.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.69 163.01 13.71 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 110.983 -2.826 . . . . 1.0 111.731 -172.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -69.94 -37.11 75.78 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 117.582 2.438 . . . . 1.0 117.582 -162.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -88.44 -24.32 23.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.401 -1.437 . . . . 1.0 113.174 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m -60.68 137.08 92.94 Favored Pre-proline 0 N--CA 1.438 -1.073 0 C-N-CA 126.544 1.938 . . . . 1.0 114.037 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -76.54 157.2 36.38 Favored 'Trans proline' 0 N--CA 1.441 -1.568 0 CA-C-N 123.76 2.378 . . . . 1.0 115.235 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.319 1.4 pp -62.84 -25.71 68.4 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 125.341 1.456 . . . . 1.0 114.643 179.055 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.0 t -52.8 -29.08 25.57 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.663 -1.898 . . . . 1.0 115.216 170.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HG3' HD12 ' B' ' 969' ' ' LEU . 0.1 OUTLIER -70.12 -45.58 66.57 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.01 -1.681 . . . . 1.0 111.039 -170.34 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.484 HD13 ' H ' ' A' ' 43' ' ' LEU 0.332 0.0 OUTLIER -65.81 -36.5 83.67 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 115.151 1.537 . . . . 1.0 115.151 171.465 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.1 tpp -62.27 -40.66 96.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 114.738 1.385 . . . . 1.0 114.738 177.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -65.7 -41.11 92.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 O-C-N 120.054 -1.654 . . . . 1.0 112.793 171.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.89 -37.14 83.48 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.697 -1.252 . . . . 1.0 114.078 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.39 -44.94 89.16 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.189 -1.569 . . . . 1.0 112.427 171.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.6 m -61.75 -39.96 93.45 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 124.126 0.97 . . . . 1.0 113.184 175.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -66.29 -47.82 72.37 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.5 1.12 . . . . 1.0 113.86 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -69.03 -43.32 74.96 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.383 -1.448 . . . . 1.0 114.621 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.2 mm100 -114.19 8.47 16.87 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 114.302 1.223 . . . . 1.0 114.302 -163.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.03 42.23 12.68 Favored Glycine 0 CA--C 1.494 -1.264 0 N-CA-C 116.355 1.302 . . . . 1.0 116.355 163.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 30.5 mt -116.63 162.87 16.97 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 121.176 -1.191 . . . . 1.0 110.165 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 55.0 m -102.36 132.55 48.27 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.535 -1.353 . . . . 1.0 110.019 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.8 tpt -61.78 -40.67 96.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 126.145 1.778 . . . . 1.0 114.229 -166.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -97.62 13.21 30.93 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.708 -1.245 . . . . 1.0 112.131 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -105.93 -7.51 18.14 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 124.22 1.008 . . . . 1.0 111.34 171.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.4 pt -111.76 136.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 O-C-N 121.095 -1.003 . . . . 1.0 110.015 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.1 mmt180 -123.79 139.03 54.38 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.709 -1.244 . . . . 1.0 109.54 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.432 ' HB2' HD11 ' A' ' 67' ' ' ILE . 0.1 OUTLIER -120.27 143.94 48.05 Favored 'General case' 0 N--CA 1.433 -1.323 0 O-C-N 120.675 -1.266 . . . . 1.0 111.48 -162.402 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -141.11 154.79 46.08 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 124.508 1.123 . . . . 1.0 110.445 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -133.62 117.92 17.61 Favored 'General case' 0 N--CA 1.433 -1.305 0 O-C-N 120.626 -1.296 . . . . 1.0 108.351 176.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 44.2 t0 51.62 45.05 28.7 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.117 1.767 . . . . 1.0 112.713 -175.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.2 0.96 72.78 Favored Glycine 0 N--CA 1.436 -1.349 0 N-CA-C 116.58 1.392 . . . . 1.0 116.58 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -112.64 128.92 24.94 Favored Pre-proline 0 N--CA 1.436 -1.125 0 O-C-N 120.027 -1.867 . . . . 1.0 110.728 -174.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -48.53 136.19 26.56 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 124.686 3.591 . . . . 1.0 117.952 170.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.432 HD11 ' HB2' ' A' ' 60' ' ' PHE . 4.3 pt -123.19 154.18 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.183 0 C-N-CA 125.36 1.464 . . . . 1.0 109.349 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -110.49 161.2 15.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 121.036 -1.04 . . . . 1.0 109.049 -171.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -65.88 -25.6 67.25 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 119.536 -1.978 . . . . 1.0 113.243 173.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 m -78.42 -18.4 55.03 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.531 1.932 . . . . 1.0 112.947 173.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -67.52 160.26 28.01 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-O 124.189 1.947 . . . . 1.0 112.495 174.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.3 p -144.31 162.22 40.85 Favored Pre-proline 0 CA--C 1.496 -1.133 0 CA-C-N 114.472 -1.24 . . . . 1.0 110.025 -158.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -60.56 -32.44 93.5 Favored 'Trans proline' 0 N--CA 1.439 -1.698 0 C-N-CA 123.2 2.6 . . . . 1.0 114.558 168.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.22 -45.73 83.52 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 122.264 1.03 . . . . 1.0 113.155 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -71.22 -44.36 65.53 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 124.735 1.214 . . . . 1.0 113.2 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -87.75 -8.35 56.14 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 113.568 0.951 . . . . 1.0 113.568 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.29 42.24 15.29 Favored 'General case' 0 N--CA 1.435 -1.214 0 C-N-CA 128.664 2.786 . . . . 1.0 115.901 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtm -69.61 154.24 42.29 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 126.861 2.065 . . . . 1.0 113.832 169.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -141.02 -175.09 4.18 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 105.919 -1.882 . . . . 1.0 105.919 -164.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.337 4.0 p-10 -50.45 -26.47 5.11 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 118.875 2.917 . . . . 1.0 118.875 -167.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -141.48 58.54 1.51 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.34 1.056 . . . . 1.0 113.062 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 169.35 16.87 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 119.005 -2.31 . . . . 1.0 116.821 -173.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.3 m -131.87 122.12 25.17 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 124.998 1.319 . . . . 1.0 112.182 -176.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 52.8 mt -112.91 140.73 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.061 0 C-N-CA 127.65 2.38 . . . . 1.0 108.132 175.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -110.95 134.28 52.7 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 120.66 -1.275 . . . . 1.0 108.615 -177.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.69 132.96 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 C-N-CA 125.328 1.451 . . . . 1.0 107.139 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -130.52 134.23 46.88 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.732 1.253 . . . . 1.0 110.956 177.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -88.05 140.25 29.68 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 124.988 1.315 . . . . 1.0 112.968 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 N--CA 1.434 -1.238 0 C-N-CA 126.017 1.727 . . . . 1.0 112.162 -172.78 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . 0.824 HG11 HG22 ' A' ' 30' ' ' VAL . 2.2 t . . . . . 0 N--CA 1.437 -1.1 0 N-CA-C 113.391 0.886 . . . . 1.0 113.391 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -109.56 125.19 66.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 O-C-N 118.962 -2.337 . . . . 1.0 112.763 -146.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -99.37 125.05 44.98 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.12 2.168 . . . . 1.0 110.382 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.508 HD12 ' HG3' ' A' ' 42' ' ' LYS . 2.0 mm? . . . . . 0 N--CA 1.436 -1.136 0 N-CA-C 116.165 1.913 . . . . 1.0 116.165 -173.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.497 -1.058 0 N-CA-C 115.85 1.796 . . . . 1.0 115.85 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.6 pt -140.35 160.76 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 128.568 2.747 . . . . 1.0 105.832 175.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -109.44 144.75 37.24 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 118.838 -2.414 . . . . 1.0 107.995 168.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -137.38 147.76 45.72 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.613 -1.93 . . . . 1.0 106.988 175.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -116.83 150.59 38.12 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 125.6 1.56 . . . . 1.0 113.022 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.453 HG23 HD11 ' A' ' 43' ' ' LEU . 9.9 t -111.78 125.98 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.206 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 170.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.34 134.48 54.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 122.406 1.098 . . . . 1.0 112.593 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.398 0 O-C-N 120.744 -1.222 . . . . 1.0 111.319 177.022 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.4 t . . . . . 0 N--CA 1.435 -1.198 0 N-CA-C 109.195 -0.668 . . . . 1.0 109.195 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.18 138.73 53.69 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 O-C-N 120.236 -1.54 . . . . 1.0 110.383 169.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.12 145.05 50.12 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 123.183 1.468 . . . . 1.0 112.696 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.621 ' CD2' HG21 ' B' ' 967' ' ' ILE 0.342 0.5 OUTLIER -144.41 140.61 29.11 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.118 -1.614 . . . . 1.0 108.627 -158.274 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.323 35.6 ttpt -110.96 115.5 29.59 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 123.428 1.585 . . . . 1.0 112.037 -170.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.72 HD11 HG21 ' A' ' 38' ' ' THR . 4.6 tp -154.81 154.83 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 127.498 3.523 . . . . 1.0 112.624 -163.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.706 ' H ' HD12 ' A' ' 34' ' ' ILE . 11.4 mptt -64.12 142.88 58.25 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 109.414 -3.539 . . . . 1.0 113.685 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.9 ttt-85 -71.2 -28.48 64.25 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.168 -1.378 . . . . 1.0 113.516 -173.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -76.21 -29.84 57.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 115.648 1.721 . . . . 1.0 115.648 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.72 HG21 HD11 ' A' ' 34' ' ' ILE . 75.0 m -62.49 141.26 96.68 Favored Pre-proline 0 N--CA 1.439 -1.004 0 C-N-CA 127.425 2.29 . . . . 1.0 114.288 -175.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -56.27 145.93 74.89 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 123.957 3.104 . . . . 1.0 116.797 174.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.426 HD21 ' O ' ' A' ' 68' ' ' ASN 0.291 1.3 pt? -63.74 -25.61 68.27 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 114.498 1.296 . . . . 1.0 114.498 172.108 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.8 t -52.64 -29.13 24.58 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 125.787 1.635 . . . . 1.0 114.62 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -65.77 -42.47 90.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.314 -2.116 . . . . 1.0 112.553 176.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.453 HD11 HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -62.87 -41.58 99.44 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 126.441 1.896 . . . . 1.0 114.463 171.411 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 77.0 mtp -57.31 -45.9 83.75 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 113.578 0.955 . . . . 1.0 113.578 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -66.35 -40.2 89.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.456 -1.403 . . . . 1.0 113.044 173.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.34 83.41 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.563 -1.336 . . . . 1.0 114.054 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -61.58 -42.28 98.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 O-C-N 120.21 -1.556 . . . . 1.0 110.83 172.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.8 m -61.35 -46.34 90.65 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.135 1.532 . . . . 1.0 115.135 173.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -69.55 -49.85 50.47 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 115.873 1.805 . . . . 1.0 115.873 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -70.63 -38.18 73.88 Favored 'General case' 0 CA--C 1.493 -1.236 0 C-N-CA 125.632 1.573 . . . . 1.0 113.877 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.96 10.95 20.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 O-C-N 121.509 -0.745 . . . . 1.0 111.676 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.81 44.75 24.06 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.756 1.462 . . . . 1.0 116.756 161.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.2 mt -121.66 154.47 36.79 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 121.469 -1.019 . . . . 1.0 110.957 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.0 m -100.14 136.27 40.29 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 120.514 -1.366 . . . . 1.0 109.923 174.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.4 tpt -59.55 -35.05 73.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.86 2.064 . . . . 1.0 114.055 -176.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ptt-85 -90.0 4.15 51.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.203 1.801 . . . . 1.0 111.151 -174.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.02 -14.49 16.44 Favored 'General case' 0 N--CA 1.432 -1.367 0 O-C-N 121.024 -1.047 . . . . 1.0 111.854 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.6 pt -127.76 159.97 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 119.897 1.226 . . . . 1.0 112.282 -166.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -138.31 147.71 43.85 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.201 -1.037 . . . . 1.0 108.201 169.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.458 ' HB3' HD11 ' A' ' 67' ' ' ILE . 63.5 m-85 -104.6 144.57 31.52 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 126.455 1.902 . . . . 1.0 107.438 -172.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.687 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 7.5 tmm_? -152.19 144.81 24.21 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 -167.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.687 ' CG ' ' HA ' ' A' ' 61' ' ' ARG 0.804 0.0 OUTLIER -123.1 142.63 50.67 Favored 'General case' 0 N--CA 1.408 -2.566 1 N-CA-C 94.606 -6.072 . . . . 1.0 94.606 -122.145 . . . . . . . . 5 4 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -69.83 74.68 0.44 Allowed 'General case' 0 N--CA 1.438 -1.038 0 O-C-N 119.747 -1.845 . . . . 1.0 115.434 -159.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.42 3.93 78.73 Favored Glycine 0 N--CA 1.433 -1.518 0 C-N-CA 127.639 2.542 . . . . 1.0 112.251 -159.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.632 ' O ' ' HB2' ' A' ' 62' ' ' PHE . 53.4 mt-30 -123.75 153.22 66.77 Favored Pre-proline 0 N--CA 1.428 -1.532 1 N-CA-C 99.719 -4.178 . . . . 1.0 99.719 -158.3 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.65 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 55.5 Cg_endo -72.12 135.97 26.1 Favored 'Trans proline' 0 N--CA 1.444 -1.406 1 C-N-CA 125.457 4.105 . . . . 1.0 116.295 148.22 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.567 HG12 ' HB3' ' A' ' 62' ' ' PHE . 5.8 pt -117.59 127.24 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.117 0 C-N-CA 126.897 2.079 . . . . 1.0 108.976 171.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.426 ' O ' HD21 ' A' ' 40' ' ' LEU . 39.4 m-80 -112.8 158.75 19.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 125.381 1.473 . . . . 1.0 108.772 175.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -59.99 -25.32 65.15 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 118.9 -2.375 . . . . 1.0 116.947 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 m -92.35 -2.27 56.49 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.622 -1.299 . . . . 1.0 111.351 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -73.18 171.81 12.28 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 119.311 -2.118 . . . . 1.0 111.988 172.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 64.9 p -146.34 154.41 49.37 Favored Pre-proline 0 CA--C 1.495 -1.141 0 O-C-N 120.097 -1.627 . . . . 1.0 109.415 -162.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.404 ' HB3' ' HB2' ' A' ' 78' ' ' MET . 39.7 Cg_exo -58.16 -31.64 93.8 Favored 'Trans proline' 0 N--CA 1.44 -1.672 0 C-N-CA 123.272 2.648 . . . . 1.0 116.078 170.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.09 89.99 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -74.35 -41.11 61.59 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.966 1.306 . . . . 1.0 113.306 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.78 -8.49 59.7 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 122.124 0.964 . . . . 1.0 112.665 178.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.289 42.2 mm-40 64.43 48.16 2.82 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 126.204 1.802 . . . . 1.0 114.416 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.404 ' HB2' ' HB3' ' A' ' 73' ' ' PRO . 66.2 mtt -82.05 154.25 25.72 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 127.03 2.132 . . . . 1.0 111.06 172.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -125.89 -178.98 4.47 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 121.062 -1.024 . . . . 1.0 109.396 -164.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.376 9.1 p-10 -54.1 -26.55 27.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 117.217 2.303 . . . . 1.0 117.217 -174.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -135.75 89.49 2.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 123.277 0.631 . . . . 1.0 111.366 158.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.7 170.53 10.06 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 116.765 2.135 . . . . 1.0 116.765 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.9 m -135.87 120.95 18.84 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 125.008 1.323 . . . . 1.0 112.473 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.8 mt -110.22 140.78 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.106 0 C-N-CA 129.972 3.309 . . . . 1.0 108.31 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -110.82 146.43 36.43 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.939 -1.726 . . . . 1.0 108.693 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.4 t -121.18 139.69 47.59 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.218 0 O-C-N 121.17 -0.956 . . . . 1.0 108.969 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -128.58 143.24 50.92 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 121.367 -0.833 . . . . 1.0 111.14 163.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -87.16 130.27 34.6 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.739 1.257 . . . . 1.0 112.76 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 . . . . . 0 N--CA 1.434 -1.248 0 C-N-CA 125.169 1.387 . . . . 1.0 111.147 -179.184 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 16.5 t . . . . . 0 CA--C 1.496 -1.134 0 CA-C-O 123.978 1.847 . . . . 1.0 114.012 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . 0.621 HG21 ' CD2' ' A' ' 32' ' ' PHE . 6.5 mt -113.05 111.01 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 C-N-CA 127.127 2.171 . . . . 1.0 110.808 -171.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -102.18 109.08 20.67 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 119.172 -2.205 . . . . 1.0 112.703 171.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.501 ' CD1' HD13 ' A' ' 34' ' ' ILE 0.275 0.4 OUTLIER . . . . . 0 CA--C 1.496 -1.115 0 CA-C-N 122.713 2.506 . . . . 1.0 114.433 -172.101 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 . . . . . 0 N--CA 1.437 -1.1 0 N-CA-C 115.511 1.671 . . . . 1.0 115.511 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -140.66 160.68 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 127.306 2.242 . . . . 1.0 109.158 -172.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -117.72 144.77 44.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 118.87 -2.393 . . . . 1.0 109.127 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -127.91 157.49 40.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 O-C-N 119.136 -2.227 . . . . 1.0 106.159 167.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 14.4 ptpt -109.35 150.6 27.78 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 125.578 1.551 . . . . 1.0 110.539 161.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.417 HG22 ' HB ' ' A' ' 84' ' ' ILE . 39.4 t -116.94 124.93 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 171.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.06 130.13 51.66 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 122.654 1.216 . . . . 1.0 111.837 -176.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.404 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . . . . . . 0 N--CA 1.434 -1.472 0 CA-C-O 122.763 1.202 . . . . 1.0 115.727 -176.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.435 -1.223 0 CA-C-O 122.297 1.046 . . . . 1.0 113.26 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.24 138.81 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.07 0 O-C-N 119.776 -1.827 . . . . 1.0 109.637 160.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -119.96 139.5 52.37 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-O 123.163 1.459 . . . . 1.0 112.309 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.521 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.0 OUTLIER -145.05 142.57 29.84 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.412 -1.43 . . . . 1.0 113.949 -163.061 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.427 ' O ' HD23 ' B' ' 969' ' ' LEU 0.305 14.0 ttpt -109.34 115.71 30.48 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.696 1.236 . . . . 1.0 114.2 -167.246 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 14.0 tt -146.28 154.75 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.461 0 CA-C-O 126.183 2.897 . . . . 1.0 110.012 -152.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.5 mtpp -107.65 158.07 17.56 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 110.768 -2.923 . . . . 1.0 111.413 -171.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -68.96 -37.99 79.14 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 117.275 2.324 . . . . 1.0 117.275 -151.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -87.95 -12.08 45.66 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 120.683 -1.26 . . . . 1.0 113.658 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 94.6 m -60.1 144.28 87.17 Favored Pre-proline 0 N--CA 1.437 -1.077 0 C-N-CA 128.091 2.556 . . . . 1.0 114.315 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -65.66 148.9 87.51 Favored 'Trans proline' 0 N--CA 1.44 -1.647 0 CA-C-N 124.935 2.798 . . . . 1.0 116.04 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.572 ' HA ' HD22 ' A' ' 43' ' ' LEU 0.368 0.6 OUTLIER -64.06 -25.66 68.21 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 115.266 1.58 . . . . 1.0 115.266 169.354 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.1 t -52.49 -29.04 22.94 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 126.917 2.087 . . . . 1.0 112.603 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -67.5 -36.87 81.9 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.431 -1.418 . . . . 1.0 111.822 -178.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.572 HD22 ' HA ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -64.08 -42.25 97.02 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 125.036 1.335 . . . . 1.0 112.144 172.015 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 ttm -58.39 -43.14 88.41 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 113.96 1.096 . . . . 1.0 113.96 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.19 -41.97 94.02 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.258 1.023 . . . . 1.0 112.429 173.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -38.6 90.43 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.525 -1.359 . . . . 1.0 114.459 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.472 ' CE2' HD12 ' A' ' 53' ' ' LEU . 12.5 t80 -60.98 -41.28 96.15 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 126.37 1.868 . . . . 1.0 111.769 173.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.2 m -62.92 -45.11 94.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.802 -1.186 . . . . 1.0 113.987 171.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -64.52 -51.74 61.34 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 119.944 -1.723 . . . . 1.0 114.618 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -76.43 -43.27 40.91 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 115.028 1.492 . . . . 1.0 115.028 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.63 2.25 25.8 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 121.289 -0.882 . . . . 1.0 110.602 -166.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.54 7.94 85.54 Favored Glycine 0 CA--C 1.493 -1.316 0 N-CA-C 117.576 1.79 . . . . 1.0 117.576 164.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.472 HD12 ' CE2' ' A' ' 47' ' ' TYR . 10.1 mt -83.79 166.76 17.72 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 119.165 1.482 . . . . 1.0 113.577 -172.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 67.1 m -102.28 131.47 48.84 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.519 -1.363 . . . . 1.0 112.052 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.5 ptp -66.51 -30.38 70.69 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt85 -75.18 -18.51 60.15 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.187 -1.571 . . . . 1.0 113.54 175.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -93.85 -10.62 33.38 Favored 'General case' 0 N--CA 1.435 -1.216 0 O-C-N 120.874 -1.141 . . . . 1.0 112.812 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.6 pt -114.15 146.5 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 C-N-CA 124.233 1.013 . . . . 1.0 111.204 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -136.93 137.08 39.18 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.731 -1.231 . . . . 1.0 108.479 167.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -103.27 148.62 25.61 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.024 -1.048 . . . . 1.0 111.227 -174.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -138.7 162.09 35.54 Favored 'General case' 0 N--CA 1.433 -1.276 0 O-C-N 120.97 -1.081 . . . . 1.0 109.864 174.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -115.33 110.04 18.8 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.561 -0.903 . . . . 1.0 108.561 164.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.5 t0 41.29 55.65 3.28 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.303 2.241 . . . . 1.0 114.738 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 2.32 90.64 Favored Glycine 0 N--CA 1.435 -1.368 0 N-CA-C 117.691 1.836 . . . . 1.0 117.691 -176.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -109.87 119.64 47.01 Favored Pre-proline 0 N--CA 1.435 -1.175 0 CA-C-N 120.954 2.377 . . . . 1.0 110.786 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -46.61 136.98 15.8 Favored 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 124.525 3.483 . . . . 1.0 117.391 165.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 pt -123.26 153.56 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 C-N-CA 125.132 1.373 . . . . 1.0 107.878 177.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -112.6 162.15 16.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.612 -1.305 . . . . 1.0 110.747 -172.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -73.93 -15.25 61.13 Favored 'General case' 0 N--CA 1.436 -1.135 0 O-C-N 119.16 -2.212 . . . . 1.0 115.058 -176.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.8 m -95.16 -3.64 47.52 Favored 'General case' 0 N--CA 1.438 -1.066 0 O-C-N 120.606 -1.309 . . . . 1.0 111.65 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -73.1 169.98 15.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 118.22 -2.8 . . . . 1.0 111.369 169.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 53.2 p -148.32 160.52 36.65 Favored Pre-proline 0 CA--C 1.495 -1.146 0 O-C-N 119.707 -1.871 . . . . 1.0 110.125 -157.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -58.51 -34.52 98.85 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.301 2.667 . . . . 1.0 114.748 167.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.1 -45.99 75.55 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 114.118 1.155 . . . . 1.0 114.118 175.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -70.41 -39.06 74.68 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.115 1.366 . . . . 1.0 114.056 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.6 tp -86.9 -8.49 57.22 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 120.759 -1.213 . . . . 1.0 112.355 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.263 40.7 mt-10 61.97 43.86 8.74 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 126.64 1.976 . . . . 1.0 114.382 177.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.2 mtt -57.23 154.19 10.72 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 128.262 2.625 . . . . 1.0 113.052 167.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -116.99 -177.44 3.2 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 120.981 -1.074 . . . . 1.0 108.848 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.373 10.4 p-10 -57.74 -26.6 62.06 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 126.318 1.847 . . . . 1.0 115.636 -178.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -139.15 85.94 2.1 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.13 1.772 . . . . 1.0 110.344 166.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.28 165.37 16.5 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 120.432 -1.417 . . . . 1.0 113.807 175.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 69.5 m -132.01 121.37 23.79 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.216 1.406 . . . . 1.0 110.677 172.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.417 ' HB ' HG22 ' A' ' 22' ' ' VAL . 46.2 mm -115.55 140.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 C-N-CA 127.134 2.174 . . . . 1.0 109.315 -178.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -111.16 139.83 46.22 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 120.193 -1.567 . . . . 1.0 111.97 -164.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.404 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 9.9 t -113.15 133.61 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 CA-C-O 122.766 1.27 . . . . 1.0 111.165 -178.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.74 138.11 51.71 Favored 'General case' 0 N--CA 1.433 -1.279 0 CA-C-O 122.554 1.169 . . . . 1.0 110.651 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.7 mm100 -89.43 137.01 32.7 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 124.242 1.017 . . . . 1.0 111.195 -175.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 . . . . . 0 N--CA 1.433 -1.291 0 N-CA-C 115.219 1.562 . . . . 1.0 115.219 -174.969 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.435 -1.219 0 CA-C-O 123.494 1.616 . . . . 1.0 113.974 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . 0.521 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 7.0 mt -113.21 129.09 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 C-N-CA 127.454 2.302 . . . . 1.0 113.298 -165.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -102.08 129.59 48.46 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.292 -1.505 . . . . 1.0 108.174 167.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.427 HD23 ' O ' ' A' ' 33' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.437 -1.095 0 N-CA-C 117.919 2.563 . . . . 1.0 117.919 -170.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.5 m170 . . . . . 0 N--CA 1.437 -1.121 0 N-CA-C 112.618 0.599 . . . . 1.0 112.618 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 24.7 pt -143.03 160.65 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 126.394 1.877 . . . . 1.0 106.951 170.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -117.71 144.8 44.92 Favored 'General case' 0 N--CA 1.432 -1.33 0 O-C-N 119.3 -2.125 . . . . 1.0 108.982 176.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -127.5 146.04 50.64 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 119.938 -1.726 . . . . 1.0 107.455 168.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.9 ptpt -106.45 150.62 25.89 Favored 'General case' 0 CA--C 1.493 -1.22 0 O-C-N 120.111 -1.618 . . . . 1.0 111.311 165.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.4 p -119.22 124.52 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 N-CA-C 107.106 -1.442 . . . . 1.0 107.106 172.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 130.2 49.07 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 123.083 1.42 . . . . 1.0 112.739 -171.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.442 0 CA-C-O 123.256 1.476 . . . . 1.0 115.801 -178.022 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.4 t . . . . . 0 N--CA 1.436 -1.157 0 CA-C-O 120.72 0.295 . . . . 1.0 110.922 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -128.04 137.88 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 N-CA-C 106.08 -1.822 . . . . 1.0 106.08 163.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.43 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -117.73 140.15 50.07 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-O 123.61 1.671 . . . . 1.0 111.269 161.66 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.56 ' CD2' HG21 ' B' ' 967' ' ' ILE 0.355 10.8 t80 -139.91 140.48 36.44 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 -155.141 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.279 27.3 ttpt -115.02 115.64 27.16 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-O 122.403 1.097 . . . . 1.0 111.013 -171.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.402 HD12 ' HE1' ' A' ' 32' ' ' PHE . 3.1 tt -140.09 154.7 23.46 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-O 124.216 1.96 . . . . 1.0 111.997 -155.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -100.24 157.3 16.69 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 123.282 1.515 . . . . 1.0 111.758 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 ttt-85 -71.25 -23.12 61.93 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 117.848 2.536 . . . . 1.0 117.848 -154.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -90.44 -19.68 23.62 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.039 -1.663 . . . . 1.0 112.438 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.5 m -60.9 140.45 93.62 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 126.33 1.852 . . . . 1.0 114.132 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -68.62 152.05 74.76 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 CA-C-N 124.052 2.483 . . . . 1.0 116.308 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.291 0.4 OUTLIER -69.06 -25.47 64.47 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 126.657 1.983 . . . . 1.0 112.41 168.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 89.9 p -52.69 -29.15 25.02 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.098 -2.251 . . . . 1.0 115.024 173.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -67.74 -36.07 79.88 Favored 'General case' 0 N--CA 1.427 -1.614 0 O-C-N 119.75 -1.844 . . . . 1.0 110.686 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.431 ' HA ' ' CE2' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -63.57 -41.94 98.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 127.553 2.341 . . . . 1.0 112.497 171.011 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 56.1 ttm -61.53 -44.49 96.96 Favored 'General case' 0 N--CA 1.433 -1.28 0 O-C-N 120.857 -1.152 . . . . 1.0 113.7 174.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -67.21 -40.08 86.4 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.226 -0.921 . . . . 1.0 112.747 176.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.412 ' HB1' HD13 ' B' ' 967' ' ' ILE . . . -64.99 -38.6 91.49 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.763 -1.21 . . . . 1.0 113.686 179.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -59.77 -40.11 87.1 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.218 1.807 . . . . 1.0 111.907 170.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.9 m -67.72 -44.4 77.74 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.629 -1.92 . . . . 1.0 114.489 172.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.42 -46.51 76.26 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.054 -1.654 . . . . 1.0 114.045 179.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 24.6 mtt180 -78.59 -42.19 29.71 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 116.572 2.064 . . . . 1.0 116.572 177.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.15 4.83 25.29 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.8 -1.187 . . . . 1.0 112.001 -166.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.11 5.72 85.46 Favored Glycine 0 N--CA 1.438 -1.22 0 N-CA-C 117.856 1.902 . . . . 1.0 117.856 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.15 165.5 20.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.916 -1.344 . . . . 1.0 113.748 -173.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -102.34 129.71 48.87 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.326 -1.484 . . . . 1.0 111.036 171.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -66.47 -22.52 66.2 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 119.835 -1.791 . . . . 1.0 115.464 -172.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -91.29 3.87 53.77 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 124.937 1.295 . . . . 1.0 112.513 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -112.91 -6.12 13.8 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 124.622 1.169 . . . . 1.0 112.4 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 31.6 pt -124.35 142.46 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.694 -1.253 . . . . 1.0 110.263 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -138.21 154.93 49.09 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 124.86 1.264 . . . . 1.0 108.159 172.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -116.04 148.71 39.9 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-O 123.028 1.394 . . . . 1.0 112.923 -167.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -136.3 152.55 50.81 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-O 122.421 1.105 . . . . 1.0 110.072 175.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -130.55 111.58 12.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.728 1.211 . . . . 1.0 108.733 -178.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.8 t70 48.63 44.85 21.42 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 126.409 1.883 . . . . 1.0 113.997 -174.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.5 1.69 88.96 Favored Glycine 0 N--CA 1.436 -1.323 0 N-CA-C 117.051 1.58 . . . . 1.0 117.051 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -109.96 137.7 20.56 Favored Pre-proline 0 N--CA 1.436 -1.175 0 CA-C-N 119.978 1.889 . . . . 1.0 110.365 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.74 144.99 36.05 Favored 'Trans proline' 0 N--CA 1.44 -1.659 0 C-N-CA 122.616 2.211 . . . . 1.0 112.466 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.0 pt -120.75 151.28 23.64 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.141 0 C-N-CA 124.644 1.177 . . . . 1.0 108.828 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -112.7 163.42 14.58 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.8 -1.188 . . . . 1.0 109.803 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -70.19 -13.94 62.41 Favored 'General case' 0 N--CA 1.436 -1.142 0 O-C-N 119.726 -1.859 . . . . 1.0 112.895 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.0 m -84.55 -11.84 55.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 125.948 1.699 . . . . 1.0 112.164 171.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -83.43 173.19 11.72 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.449 -2.032 . . . . 1.0 110.721 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 76.9 p -153.48 159.23 32.38 Favored Pre-proline 0 CA--C 1.498 -1.055 0 O-C-N 120.748 -1.22 . . . . 1.0 111.027 -161.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.87 -32.27 95.05 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 C-N-CA 123.616 2.877 . . . . 1.0 115.17 171.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.29 -46.03 78.37 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-O 122.54 1.162 . . . . 1.0 113.59 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -69.58 -40.77 76.53 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 125.424 1.49 . . . . 1.0 113.452 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 16.4 tp -87.74 -8.4 56.09 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.811 -1.18 . . . . 1.0 111.696 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 60.13 48.25 8.59 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 127.5 2.32 . . . . 1.0 114.443 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.66 151.29 25.25 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 127.169 2.188 . . . . 1.0 115.081 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -105.6 175.95 5.32 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.089 1.756 . . . . 1.0 110.518 -175.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -56.26 -26.59 52.18 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 126.297 1.839 . . . . 1.0 115.528 176.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.73 89.69 2.34 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 124.438 1.095 . . . . 1.0 108.826 163.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.86 169.68 12.33 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.187 -1.57 . . . . 1.0 114.283 174.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.9 m -130.84 118.07 20.25 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 124.809 1.243 . . . . 1.0 111.012 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 24.2 mm -105.74 140.56 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 127.575 2.35 . . . . 1.0 107.981 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -110.98 142.58 42.92 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 120.445 -1.409 . . . . 1.0 109.2 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.5 139.64 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 O-C-N 120.494 -1.379 . . . . 1.0 109.297 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -123.71 140.67 52.76 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.714 -1.217 . . . . 1.0 107.714 165.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -86.03 133.12 33.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 120.966 -1.084 . . . . 1.0 109.893 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 . . . . . 0 N--CA 1.434 -1.236 0 O-C-N 120.939 -1.101 . . . . 1.0 112.532 -163.632 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . 0.418 ' HB ' ' O ' ' A' ' 31' ' ' GLN . 42.0 t . . . . . 0 N--CA 1.435 -1.189 0 CA-C-O 123.765 1.745 . . . . 1.0 110.836 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . 0.56 HG21 ' CD2' ' A' ' 32' ' ' PHE . 2.3 mt -113.12 118.43 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 C-N-CA 127.811 2.444 . . . . 1.0 111.432 -167.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -102.12 114.24 28.2 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.021 -1.674 . . . . 1.0 109.19 169.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.497 -1.07 0 CA-C-N 121.725 2.057 . . . . 1.0 115.476 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.2 p-80 . . . . . 0 N--CA 1.437 -1.106 0 N-CA-C 118.602 2.816 . . . . 1.0 118.602 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 pt -139.39 160.78 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 C-N-CA 129.43 3.092 . . . . 1.0 107.297 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -111.94 144.86 40.58 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 119.844 -1.785 . . . . 1.0 109.926 165.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.15 156.69 46.94 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 119.361 -2.087 . . . . 1.0 107.071 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 ptpt -125.37 150.67 47.0 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 126.363 1.865 . . . . 1.0 112.833 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -117.55 124.82 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 125.295 1.438 . . . . 1.0 107.88 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.9 130.19 51.87 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-O 122.613 1.196 . . . . 1.0 113.418 -176.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.386 0 C-N-CA 124.823 1.201 . . . . 1.0 113.349 173.945 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.435 -1.179 0 CA-C-O 121.612 0.72 . . . . 1.0 111.973 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -129.17 138.72 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 O-C-N 120.619 -1.301 . . . . 1.0 109.923 176.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.75 146.56 46.92 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 124.025 1.869 . . . . 1.0 114.619 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.61 146.39 47.86 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.857 -1.777 . . . . 1.0 107.952 -163.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.255 37.5 ttpt -112.04 115.76 29.44 Favored 'General case' 0 CA--C 1.494 -1.188 0 O-C-N 120.482 -1.386 . . . . 1.0 111.822 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.98 154.58 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-O 124.24 1.971 . . . . 1.0 110.972 -160.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.31 158.97 19.55 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.608 -2.087 . . . . 1.0 112.625 -176.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ttt-85 -71.31 -38.02 71.77 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 115.817 1.784 . . . . 1.0 115.817 -161.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -91.06 -16.61 27.6 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.769 -1.207 . . . . 1.0 113.571 -178.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 63.8 m -63.37 138.18 97.28 Favored Pre-proline 0 N--CA 1.437 -1.117 0 C-N-CA 125.331 1.452 . . . . 1.0 112.566 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -65.74 156.27 64.85 Favored 'Trans proline' 0 N--CA 1.44 -1.66 0 CA-C-N 124.023 2.473 . . . . 1.0 116.306 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.422 1.8 pp -61.39 -25.62 67.3 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 126.317 1.847 . . . . 1.0 114.006 172.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 93.2 p -52.58 -29.02 23.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.944 -1.722 . . . . 1.0 114.879 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -42.66 77.4 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.5 -2.0 . . . . 1.0 112.73 -174.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.14 -35.44 80.48 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.362 -1.461 . . . . 1.0 113.208 170.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.9 ttt -61.42 -41.75 97.66 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.193 -1.567 . . . . 1.0 114.805 173.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.96 -43.03 99.69 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 125.761 1.624 . . . . 1.0 111.989 172.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.73 81.95 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 174.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -59.79 -43.42 94.44 Favored 'General case' 0 N--CA 1.437 -1.112 0 C-N-CA 126.213 1.805 . . . . 1.0 111.662 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.5 m -60.39 -43.41 96.68 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 125.249 1.419 . . . . 1.0 114.174 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.75 -51.55 54.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 114.99 1.478 . . . . 1.0 114.99 174.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -42.29 59.3 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.761 -1.212 . . . . 1.0 113.749 -172.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -112.33 0.47 15.7 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 113.053 0.76 . . . . 1.0 113.053 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 41.46 28.52 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 118.093 1.997 . . . . 1.0 118.093 163.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.4 mt -121.58 168.02 12.22 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.282 1.433 . . . . 1.0 111.215 -171.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 t -102.22 133.04 47.74 Favored 'General case' 0 N--CA 1.436 -1.149 0 O-C-N 120.502 -1.374 . . . . 1.0 112.927 176.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 23.8 ptp -66.55 -18.57 65.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.397 1.628 . . . . 1.0 115.397 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -96.59 1.52 51.33 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.613 -1.304 . . . . 1.0 113.061 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -110.37 -31.5 7.27 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 119.722 -1.861 . . . . 1.0 111.769 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.2 pp -115.27 135.25 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 O-C-N 121.615 -0.678 . . . . 1.0 110.661 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -132.75 154.93 49.74 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.137 -1.602 . . . . 1.0 111.329 -171.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.425 ' HB3' HD11 ' A' ' 67' ' ' ILE . 16.9 m-30 -104.17 148.66 26.04 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.297 -1.502 . . . . 1.0 113.055 -166.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -147.34 145.1 29.2 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 125.079 1.352 . . . . 1.0 108.213 -171.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -129.97 110.29 11.55 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 120.615 -1.303 . . . . 1.0 109.026 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 52.57 47.15 25.31 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.757 2.023 . . . . 1.0 114.038 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.93 4.89 86.39 Favored Glycine 0 N--CA 1.435 -1.416 0 O-C-N 120.371 -1.456 . . . . 1.0 116.289 -176.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -114.6 132.2 22.99 Favored Pre-proline 0 N--CA 1.434 -1.238 0 CA-C-N 120.386 2.093 . . . . 1.0 109.08 -177.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.63 135.26 34.05 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 123.869 3.046 . . . . 1.0 115.797 163.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.425 HD11 ' HB3' ' A' ' 60' ' ' PHE . 4.7 pt -119.66 142.85 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 105.943 -1.873 . . . . 1.0 105.943 174.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -100.14 158.25 15.99 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.796 -1.19 . . . . 1.0 108.574 -169.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -66.12 -26.0 67.25 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 119.382 -2.074 . . . . 1.0 113.569 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.3 m -78.48 -12.63 60.02 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 126.215 1.806 . . . . 1.0 113.213 171.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.94 172.64 11.9 Favored 'General case' 0 N--CA 1.432 -1.343 0 O-C-N 118.663 -2.523 . . . . 1.0 111.711 174.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 54.4 p -148.11 160.83 36.39 Favored Pre-proline 0 CA--C 1.495 -1.143 0 O-C-N 120.094 -1.629 . . . . 1.0 109.24 -159.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 99.7 Cg_exo -55.83 -36.14 94.9 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.275 2.65 . . . . 1.0 115.909 164.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.45 -45.7 82.72 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 114.124 1.157 . . . . 1.0 114.124 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -71.66 -43.16 66.55 Favored 'General case' 0 N--CA 1.433 -1.299 0 C-N-CA 124.694 1.197 . . . . 1.0 111.886 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -4.56 56.41 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.81 0.814 . . . . 1.0 111.754 -175.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.267 51.2 mt-10 60.02 48.33 8.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 C-N-CA 127.129 2.172 . . . . 1.0 115.106 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.9 mtt -73.64 153.6 40.08 Favored 'General case' 0 N--CA 1.432 -1.335 0 C-N-CA 126.653 1.981 . . . . 1.0 111.675 173.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.579 ' HG3' ' H ' ' A' ' 81' ' ' GLU . 10.7 pt-20 -118.14 178.7 4.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 O-C-N 120.568 -1.333 . . . . 1.0 110.606 -168.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.259 9.6 p-10 -52.92 -26.55 15.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.987 2.515 . . . . 1.0 116.556 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.579 ' H ' ' HG3' ' A' ' 79' ' ' GLU . 50.9 mt-10 -136.61 66.32 1.48 Allowed 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 125.12 1.368 . . . . 1.0 111.854 167.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.73 167.35 19.22 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 116.966 2.21 . . . . 1.0 116.966 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.4 m -127.63 125.38 40.07 Favored 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 126.17 1.788 . . . . 1.0 112.121 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 73.9 mt -114.33 140.76 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 C-N-CA 129.233 3.013 . . . . 1.0 109.172 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -110.9 141.48 44.26 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.965 1.706 . . . . 1.0 106.597 -171.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.7 t -108.54 131.6 58.68 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.257 0 O-C-N 120.783 -1.198 . . . . 1.0 108.82 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -118.46 135.31 54.44 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 123.456 1.598 . . . . 1.0 111.822 164.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.14 140.5 29.4 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 125.414 1.486 . . . . 1.0 111.816 -172.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 . . . . . 0 N--CA 1.435 -1.222 0 O-C-N 121.077 -1.014 . . . . 1.0 111.67 -178.605 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.292 0.2 OUTLIER . . . . . 0 N--CA 1.435 -1.222 0 N-CA-C 116.381 1.993 . . . . 1.0 116.381 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -113.05 115.22 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 124.573 1.149 . . . . 1.0 109.276 -168.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -102.16 122.94 45.13 Favored 'General case' 0 N--CA 1.434 -1.237 0 O-C-N 120.139 -1.6 . . . . 1.0 110.364 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 969' ' ' LEU . . . . . 0.415 ' HA ' HD13 ' B' ' 969' ' ' LEU . 3.2 mm? . . . . . 0 N--CA 1.435 -1.182 0 O-C-N 120.167 -1.583 . . . . 1.0 114.989 -175.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.3 mmt . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 119.9 -0.095 . . . . 1.0 111.144 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.26 -8.31 51.29 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.566 -1.334 . . . . 1.0 111.896 174.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -78.77 159.36 27.94 Favored 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 127.635 2.374 . . . . 1.0 113.801 177.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -93.61 130.56 39.47 Favored 'General case' 0 N--CA 1.433 -1.294 0 O-C-N 120.579 -1.326 . . . . 1.0 109.545 174.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -91.82 129.51 41.94 Favored Pre-proline 0 N--CA 1.435 -1.207 0 O-C-N 120.38 -1.45 . . . . 1.0 112.154 -176.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -53.34 155.93 11.64 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 124.401 3.401 . . . . 1.0 116.425 165.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -157.32 11.18 0.21 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 113.313 0.857 . . . . 1.0 113.313 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.5 120.62 12.04 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 119.908 -1.745 . . . . 1.0 114.277 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.18 5.78 88.68 Favored Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 124.667 1.127 . . . . 1.0 115.682 -175.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.1 t -106.52 117.7 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.105 0 CA-C-N 119.046 1.423 . . . . 1.0 109.022 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -75.81 -47.3 26.28 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-O 123.434 1.588 . . . . 1.0 113.395 -178.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 20.8 p -142.51 142.27 32.23 Favored 'General case' 0 CA--C 1.494 -1.204 0 C-N-CA 125.913 1.685 . . . . 1.0 108.949 -175.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -104.25 125.26 50.37 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 121.334 -0.854 . . . . 1.0 109.766 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . 0.307 0.5 OUTLIER 13.22 91.88 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 120.406 3.484 . . . . 1.0 120.406 174.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.9 t30 79.85 40.76 0.08 Allowed 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 126.921 2.088 . . . . 1.0 111.893 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 83.93 27.25 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 C-N-CA 126.669 1.987 . . . . 1.0 112.859 161.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -81.76 133.34 35.33 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.544 -1.347 . . . . 1.0 112.609 173.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.9 pt -143.03 160.72 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 C-N-CA 131.29 3.836 . . . . 1.0 106.541 -174.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -116.05 144.85 43.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.769 -2.457 . . . . 1.0 110.566 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.459 HD22 HG21 ' A' ' 34' ' ' ILE . 1.8 pt? -132.25 157.2 44.97 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 119.375 -2.078 . . . . 1.0 106.084 173.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.3 ptpt -122.25 150.0 42.91 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 120.009 -1.682 . . . . 1.0 110.456 168.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.3 t -120.46 126.05 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.01 130.21 53.1 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 122.876 1.322 . . . . 1.0 112.114 -176.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.16 178.84 50.98 Favored Glycine 0 N--CA 1.433 -1.505 0 CA-C-O 123.351 1.528 . . . . 1.0 115.133 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -64.94 -33.6 76.42 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 125.882 1.673 . . . . 1.0 111.445 173.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -90.44 7.49 38.5 Favored 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 125.935 1.694 . . . . 1.0 112.937 -174.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.86 9.4 85.47 Favored Glycine 0 N--CA 1.436 -1.309 0 O-C-N 120.526 -1.359 . . . . 1.0 115.305 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.3 m -86.37 132.73 33.89 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 121.418 -1.048 . . . . 1.0 110.425 176.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -139.84 133.81 36.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.13 0 C-N-CA 124.232 1.013 . . . . 1.0 112.782 -167.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.549 ' CG2' HG21 ' B' ' 966' ' ' VAL . 0.4 OUTLIER -129.19 138.78 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.067 0 O-C-N 120.566 -1.334 . . . . 1.0 110.178 170.174 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.46 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -104.07 158.49 16.39 Favored 'General case' 0 CA--C 1.494 -1.194 0 CA-C-O 123.406 1.574 . . . . 1.0 112.687 174.483 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.482 ' CD2' HD13 ' B' ' 967' ' ' ILE . 0.1 OUTLIER -145.03 152.49 40.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.725 -1.125 . . . . 1.0 108.099 -173.285 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -124.12 118.3 26.6 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 106.768 -1.568 . . . . 1.0 106.768 -176.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.568 ' HA ' HD21 ' B' ' 969' ' ' LEU . 12.7 tt -144.49 154.83 14.84 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.422 0 C-N-CA 128.247 2.619 . . . . 1.0 111.113 -154.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -102.09 157.11 17.12 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 112.054 -2.339 . . . . 1.0 112.118 -177.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -69.09 -37.97 78.73 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 115.816 1.784 . . . . 1.0 115.816 -158.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -82.77 -17.97 42.32 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 114.344 1.238 . . . . 1.0 114.344 176.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 31.9 m -61.59 131.75 92.8 Favored Pre-proline 0 N--CA 1.438 -1.032 0 C-N-CA 125.479 1.511 . . . . 1.0 112.148 -175.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.78 157.08 62.96 Favored 'Trans proline' 0 N--CA 1.441 -1.606 0 CA-C-N 124.881 2.779 . . . . 1.0 114.914 -178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.433 2.7 pp -61.98 -25.55 67.69 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 124.958 1.303 . . . . 1.0 114.484 176.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.0 p -52.67 -29.02 24.2 Favored 'General case' 0 N--CA 1.435 -1.218 0 O-C-N 119.803 -1.811 . . . . 1.0 114.897 171.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -44.17 65.43 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 119.754 -1.841 . . . . 1.0 111.521 -175.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -35.58 80.0 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.898 -1.126 . . . . 1.0 111.957 175.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 ttm -61.65 -42.09 98.42 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 119.778 -1.826 . . . . 1.0 114.11 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.7 ttpt -69.14 -37.17 78.15 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.147 -1.595 . . . . 1.0 112.503 175.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.18 -37.65 83.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 114.238 1.199 . . . . 1.0 114.238 171.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -59.13 -43.31 91.97 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.911 -1.743 . . . . 1.0 111.897 173.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 81.2 m -62.53 -42.46 99.54 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 125.009 1.323 . . . . 1.0 113.769 175.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -62.14 -48.89 78.08 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 124.594 1.157 . . . . 1.0 113.754 175.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -78.57 -43.16 27.25 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 114.85 1.426 . . . . 1.0 114.85 -174.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -114.16 9.59 17.18 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.934 -1.104 . . . . 1.0 112.793 -165.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.08 46.99 8.75 Favored Glycine 0 CA--C 1.493 -1.281 0 N-CA-C 117.67 1.828 . . . . 1.0 117.67 161.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.7 mt -125.59 160.95 28.32 Favored 'General case' 0 N--CA 1.436 -1.167 0 C-N-CA 124.566 1.147 . . . . 1.0 109.825 -170.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.2 m -102.28 133.81 46.59 Favored 'General case' 0 CA--C 1.496 -1.118 0 O-C-N 120.295 -1.503 . . . . 1.0 110.218 172.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -63.74 -32.59 74.13 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 116.527 2.047 . . . . 1.0 116.527 -169.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.6 ptm180 -78.99 -14.71 59.04 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.19 -1.569 . . . . 1.0 114.024 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 55.9 mm-40 -87.73 -16.83 33.14 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.882 -1.136 . . . . 1.0 112.616 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.1 pt -116.37 140.47 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 O-C-N 120.814 -1.179 . . . . 1.0 108.987 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -138.21 146.33 42.49 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 107.265 -1.383 . . . . 1.0 107.265 177.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.1 m-30 -107.15 148.58 28.66 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.505 1.145 . . . . 1.0 110.663 -170.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -131.98 153.95 49.81 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 124.844 1.258 . . . . 1.0 109.346 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -126.12 108.69 11.57 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 165.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 48.71 50.49 17.21 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.098 2.159 . . . . 1.0 115.371 177.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.62 6.57 89.27 Favored Glycine 0 N--CA 1.437 -1.287 0 N-CA-C 116.186 1.234 . . . . 1.0 116.186 -177.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -110.62 127.67 26.58 Favored Pre-proline 0 N--CA 1.435 -1.199 0 CA-C-N 119.564 1.682 . . . . 1.0 109.411 176.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -56.13 135.23 68.84 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 123.237 2.624 . . . . 1.0 115.54 166.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.4 pt -119.29 137.6 52.69 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 106.236 -1.764 . . . . 1.0 106.236 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -112.67 163.83 14.08 Favored 'General case' 0 N--CA 1.435 -1.206 0 O-C-N 120.717 -1.239 . . . . 1.0 108.433 -162.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -61.44 -28.3 69.17 Favored 'General case' 0 CA--C 1.497 -1.092 0 O-C-N 118.98 -2.325 . . . . 1.0 115.731 -175.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.1 m -78.51 -13.93 59.6 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 126.086 1.754 . . . . 1.0 112.459 175.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -75.89 168.93 19.12 Favored 'General case' 0 N--CA 1.432 -1.357 0 O-C-N 119.627 -1.92 . . . . 1.0 111.363 172.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p -151.43 161.72 28.83 Favored Pre-proline 0 CA--C 1.497 -1.081 0 O-C-N 119.878 -1.764 . . . . 1.0 111.047 -154.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -60.4 -31.69 92.98 Favored 'Trans proline' 0 N--CA 1.44 -1.649 0 C-N-CA 123.6 2.867 . . . . 1.0 115.417 168.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.87 -45.5 70.85 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 122.508 1.147 . . . . 1.0 112.65 173.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -70.48 -42.81 70.89 Favored 'General case' 0 N--CA 1.433 -1.295 0 C-N-CA 125.501 1.521 . . . . 1.0 113.729 -177.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 25.9 tp -85.82 -8.46 58.08 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.557 -1.339 . . . . 1.0 113.008 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 67.39 42.63 2.15 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.549 1.539 . . . . 1.0 113.608 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 63.9 mtt -62.3 148.73 44.11 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 127.065 2.146 . . . . 1.0 115.184 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -91.53 176.48 6.53 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.472 1.509 . . . . 1.0 111.431 -178.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.259 12.1 p-10 -58.16 -26.39 62.66 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 127.437 2.295 . . . . 1.0 114.477 168.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -138.26 79.15 1.72 Allowed 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 125.35 1.46 . . . . 1.0 109.686 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.68 162.44 21.82 Favored 'General case' 0 N--CA 1.437 -1.094 0 O-C-N 120.021 -1.674 . . . . 1.0 112.483 176.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.8 m -131.21 118.57 20.62 Favored 'General case' 0 CA--C 1.496 -1.11 0 C-N-CA 124.297 1.039 . . . . 1.0 110.332 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mm -119.18 140.6 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 C-N-CA 126.828 2.051 . . . . 1.0 108.937 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -111.05 149.45 30.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.281 -1.512 . . . . 1.0 110.989 -170.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.0 t -115.76 139.63 41.37 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.162 0 O-C-N 120.665 -1.272 . . . . 1.0 110.625 -174.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -121.63 142.87 49.7 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.426 -0.953 . . . . 1.0 108.426 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -89.56 120.29 30.73 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 120.864 -1.147 . . . . 1.0 109.216 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -122.83 134.2 54.41 Favored 'General case' 0 N--CA 1.435 -1.213 0 N-CA-C 114.822 1.415 . . . . 1.0 114.822 -154.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -83.02 114.67 21.43 Favored 'General case' 0 N--CA 1.433 -1.275 0 C-N-CA 125.776 1.63 . . . . 1.0 111.605 177.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 5.3 t -103.9 -2.82 25.63 Favored 'General case' 0 CA--C 1.497 -1.089 0 O-C-N 120.553 -1.342 . . . . 1.0 114.083 -169.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.01 5.89 88.9 Favored Glycine 0 CA--C 1.494 -1.241 0 O-C-N 119.758 -1.839 . . . . 1.0 116.045 167.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.705 0 N-CA-C 109.227 -1.549 . . . . 1.0 109.227 179.726 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.827 0 N-CA-C 112.137 -0.385 . . . . 1.0 112.137 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . 0.549 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.481 0.3 OUTLIER -97.06 -97.77 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 C-N-CA 124.291 1.036 . . . . 1.0 112.635 179.13 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . 0.482 HD13 ' CD2' ' A' ' 32' ' ' PHE . 4.9 mt -88.82 116.61 30.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 O-C-N 119.857 -1.777 . . . . 1.0 113.259 -163.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -102.17 109.24 20.88 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 118.903 -2.373 . . . . 1.0 109.132 160.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.568 HD21 ' HA ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -99.61 165.2 11.73 Favored 'General case' 0 CA--C 1.498 -1.053 0 O-C-N 119.651 -1.906 . . . . 1.0 114.389 -168.323 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 14.8 t -150.55 141.13 22.57 Favored 'General case' 0 CA--C 1.498 -1.04 0 O-C-N 120.198 -1.564 . . . . 1.0 113.23 170.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 23.6 ptm -153.72 25.49 0.51 Allowed 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 125.427 1.491 . . . . 1.0 110.973 165.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -145.37 7.07 1.13 Allowed 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.875 -1.141 . . . . 1.0 112.253 -162.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . 0.258 40.9 m-20 66.46 153.06 0.07 Allowed 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 123.024 1.392 . . . . 1.0 111.071 -144.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -66.37 -47.45 73.35 Favored 'General case' 0 N--CA 1.435 -1.218 0 O-C-N 119.484 -2.01 . . . . 1.0 114.717 -169.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.282 29.7 tt0 . . . . . 0 C--O 1.261 1.664 0 O-C-N 119.639 -1.913 . . . . 1.0 114.464 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.0 mtm . . . . . 0 N--CA 1.481 1.115 0 N-CA-C 111.855 0.317 . . . . 1.0 111.855 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.67 -46.47 72.28 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 129.438 3.095 . . . . 1.0 112.816 -16.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 58.97 43.57 17.64 Favored 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 126.739 2.016 . . . . 1.0 115.658 172.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -97.76 5.49 49.12 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.158 -1.589 . . . . 1.0 112.578 -168.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -64.71 152.47 90.04 Favored Pre-proline 0 N--CA 1.435 -1.202 0 C-N-CA 125.532 1.533 . . . . 1.0 115.057 -178.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -41.55 147.06 0.41 Allowed 'Trans proline' 0 N--CA 1.443 -1.498 1 C-N-CA 125.546 4.164 . . . . 1.0 119.159 168.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -120.2 126.06 49.71 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 124.192 0.997 . . . . 1.0 111.307 -173.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -99.65 -0.91 39.3 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 126.12 1.768 . . . . 1.0 112.651 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 94.62 34.69 6.19 Favored Glycine 0 N--CA 1.435 -1.381 0 O-C-N 120.338 -1.476 . . . . 1.0 114.577 174.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.9 t -77.3 116.91 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.137 0 O-C-N 121.296 -1.12 . . . . 1.0 109.367 171.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -120.58 -10.0 9.3 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.911 -1.118 . . . . 1.0 112.111 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.261 19.7 m 52.19 60.07 4.08 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 127.156 2.182 . . . . 1.0 113.146 176.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -98.3 106.06 18.29 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 120.91 -1.119 . . . . 1.0 110.579 -167.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -83.8 -33.54 24.93 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.774 -1.204 . . . . 1.0 112.285 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -62.94 150.24 42.64 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 115.926 1.824 . . . . 1.0 115.926 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 74.65 25.92 1.49 Allowed 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 126.982 2.113 . . . . 1.0 111.646 164.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -99.04 136.69 38.63 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.67 1.224 . . . . 1.0 109.271 172.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.7 pt -139.38 160.7 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 126.461 1.904 . . . . 1.0 107.282 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -117.7 144.73 44.98 Favored 'General case' 0 N--CA 1.432 -1.329 0 N-CA-C 106.092 -1.818 . . . . 1.0 106.092 170.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.7 156.06 45.56 Favored 'General case' 0 N--CA 1.435 -1.192 0 N-CA-C 105.256 -2.128 . . . . 1.0 105.256 168.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -115.72 150.61 36.55 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 125.786 1.635 . . . . 1.0 109.91 169.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.411 HG11 ' CZ ' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -111.28 127.59 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.675 0 N-CA-C 105.719 -1.956 . . . . 1.0 105.719 171.619 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -130.3 130.15 44.14 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-O 122.163 0.982 . . . . 1.0 111.581 -174.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.0 -154.31 11.83 Favored Glycine 0 CA--C 1.492 -1.395 0 N-CA-C 108.548 -1.821 . . . . 1.0 108.548 172.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 54.32 54.55 9.3 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 116.385 1.994 . . . . 1.0 116.385 160.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 59.97 40.47 18.84 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 127.941 2.497 . . . . 1.0 113.951 -178.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.09 11.34 65.1 Favored Glycine 0 N--CA 1.436 -1.334 0 O-C-N 119.851 -1.781 . . . . 1.0 114.288 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.0 m -70.31 133.53 47.06 Favored 'General case' 0 CA--C 1.497 -1.086 0 O-C-N 121.292 -1.122 . . . . 1.0 112.021 170.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 p -139.94 139.89 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 C-N-CA 123.904 0.882 . . . . 1.0 112.273 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.258 0.4 OUTLIER -129.25 138.8 53.45 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.083 0 O-C-N 119.636 -1.915 . . . . 1.0 110.531 158.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.06 139.54 53.18 Favored 'General case' 0 CA--C 1.494 -1.202 0 CA-C-O 123.425 1.583 . . . . 1.0 113.479 175.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.496 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.1 OUTLIER -144.06 146.86 33.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.745 -1.222 . . . . 1.0 112.963 -165.339 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.269 20.5 ttpt -112.78 115.85 29.15 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.858 1.263 . . . . 1.0 113.371 -166.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.9 154.67 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.303 0 CA-C-O 123.576 1.655 . . . . 1.0 110.878 -152.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -106.63 165.72 11.09 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 123.298 1.523 . . . . 1.0 114.217 -170.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -62.97 -38.17 90.04 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.193 2.294 . . . . 1.0 117.193 -159.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.28 15.88 21.58 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.536 -1.353 . . . . 1.0 113.764 -178.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 16.1 m -84.08 135.93 41.58 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 124.855 1.262 . . . . 1.0 111.723 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.13 152.6 76.19 Favored 'Trans proline' 0 N--CA 1.441 -1.571 0 C-N-CA 123.039 2.492 . . . . 1.0 114.576 173.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.332 3.4 pp -61.88 -25.69 67.7 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 114.405 1.261 . . . . 1.0 114.405 174.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 83.7 p -52.72 -29.06 24.81 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 119.538 -1.976 . . . . 1.0 116.067 166.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -74.55 -45.88 42.68 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 119.557 -1.965 . . . . 1.0 110.618 -167.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.739 HD13 ' H ' ' A' ' 43' ' ' LEU 0.327 0.0 OUTLIER -68.85 -31.13 69.86 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.695 1.368 . . . . 1.0 114.695 170.233 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 18.4 ttt -61.04 -41.72 97.11 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.397 -2.065 . . . . 1.0 114.065 173.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -41.52 98.65 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 120.876 -1.14 . . . . 1.0 112.418 170.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.61 -36.84 81.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.118 1.525 . . . . 1.0 115.118 172.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -58.94 -43.86 91.28 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 120.025 -1.672 . . . . 1.0 112.185 173.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.2 m -62.3 -42.36 99.3 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.009 1.324 . . . . 1.0 113.02 178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -67.19 -51.52 52.51 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 113.464 0.913 . . . . 1.0 113.464 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.7 -40.68 72.72 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 115.067 1.506 . . . . 1.0 115.067 -174.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -111.13 9.82 21.94 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.915 -1.116 . . . . 1.0 112.513 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.6 44.44 26.34 Favored Glycine 0 CA--C 1.493 -1.303 0 N-CA-C 115.871 1.108 . . . . 1.0 115.871 164.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.3 mt -116.92 160.41 20.95 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 121.73 -0.865 . . . . 1.0 111.725 -169.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.0 m -102.23 134.5 45.41 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 121.073 -1.017 . . . . 1.0 109.071 175.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 51.8 tpp -61.4 -37.91 85.16 Favored 'General case' 0 CA--C 1.494 -1.175 0 C-N-CA 127.276 2.23 . . . . 1.0 114.08 -165.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -95.82 1.38 53.12 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.481 -0.781 . . . . 1.0 112.072 -176.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -102.15 -3.98 26.58 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.342 1.057 . . . . 1.0 111.694 177.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.9 pt -123.33 146.12 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 C-N-CA 124.471 1.108 . . . . 1.0 108.991 168.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -138.26 148.78 45.07 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 120.65 -1.281 . . . . 1.0 107.682 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.411 ' CZ ' HG11 ' A' ' 22' ' ' VAL . 20.2 m-30 -103.32 147.54 26.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 CA-C-O 122.757 1.265 . . . . 1.0 111.854 -176.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -131.19 161.19 32.74 Favored 'General case' 0 N--CA 1.433 -1.317 0 C-N-CA 125.809 1.643 . . . . 1.0 108.135 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 48.3 t80 -138.57 124.12 19.58 Favored 'General case' 0 N--CA 1.432 -1.328 0 N-CA-C 107.615 -1.254 . . . . 1.0 107.615 165.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.4 t0 58.54 32.53 22.23 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 125.591 1.556 . . . . 1.0 114.859 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.42 8.47 87.53 Favored Glycine 0 N--CA 1.435 -1.382 0 O-C-N 119.953 -1.717 . . . . 1.0 116.104 -173.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -117.14 142.14 29.58 Favored Pre-proline 0 N--CA 1.434 -1.234 0 CA-C-N 119.028 1.414 . . . . 1.0 108.481 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -74.7 142.4 28.82 Favored 'Trans proline' 0 C--N 1.307 -1.617 0 CA-C-N 123.286 2.209 . . . . 1.0 112.271 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 8.0 pt -116.83 143.84 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 N-CA-C 106.571 -1.64 . . . . 1.0 106.571 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -89.52 154.69 19.81 Favored 'General case' 0 N--CA 1.437 -1.117 0 O-C-N 119.592 -1.943 . . . . 1.0 109.815 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -61.06 -27.71 68.54 Favored 'General case' 0 N--CA 1.437 -1.118 0 O-C-N 118.845 -2.409 . . . . 1.0 115.217 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 m -95.51 5.64 51.02 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 124.218 1.007 . . . . 1.0 111.758 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -74.56 174.89 8.39 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.256 -2.153 . . . . 1.0 110.36 165.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 34.9 p -150.41 163.29 24.73 Favored Pre-proline 0 CA--C 1.498 -1.028 0 O-C-N 119.375 -2.078 . . . . 1.0 112.556 -153.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -57.48 -33.86 97.07 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 123.857 3.038 . . . . 1.0 116.253 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.8 -44.75 69.42 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-O 122.499 1.143 . . . . 1.0 113.027 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.51 -43.96 79.61 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 124.839 1.255 . . . . 1.0 113.334 -178.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.3 tp -90.83 -8.42 49.62 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.901 -1.124 . . . . 1.0 112.58 -178.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 62.29 44.96 7.09 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 126.794 2.038 . . . . 1.0 114.532 -178.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.6 mtt -59.41 151.32 24.11 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 127.074 2.149 . . . . 1.0 112.868 171.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -120.58 177.76 4.94 Favored 'General case' 0 N--CA 1.432 -1.333 0 O-C-N 121.213 -0.93 . . . . 1.0 109.073 -170.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -56.74 -26.77 57.94 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 127.695 2.398 . . . . 1.0 115.426 -175.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -136.07 83.21 1.99 Allowed 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 123.872 0.869 . . . . 1.0 109.101 162.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.4 166.36 19.48 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 120.121 -1.612 . . . . 1.0 114.581 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 44.4 m -132.58 118.42 19.18 Favored 'General case' 0 CA--C 1.496 -1.13 0 C-N-CA 124.503 1.121 . . . . 1.0 110.925 173.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.7 mm -108.64 140.94 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 C-N-CA 129.502 3.121 . . . . 1.0 109.595 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -110.83 134.33 52.61 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 119.465 -2.022 . . . . 1.0 107.615 -164.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 t -110.95 126.71 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-O 121.643 0.735 . . . . 1.0 109.339 -173.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -116.43 143.08 46.02 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-O 122.201 1.0 . . . . 1.0 110.836 170.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -88.16 139.82 30.11 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.547 -1.346 . . . . 1.0 112.703 -175.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -136.09 167.43 21.26 Favored 'General case' 0 N--CA 1.434 -1.233 0 C-N-CA 124.385 1.074 . . . . 1.0 109.769 -174.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -131.26 120.8 23.72 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 120.99 -1.069 . . . . 1.0 110.501 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 12.0 t -160.79 157.73 27.31 Favored 'General case' 0 N--CA 1.436 -1.168 0 N-CA-C 105.344 -2.095 . . . . 1.0 105.344 168.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -112.15 -20.61 6.63 Favored Glycine 0 N--CA 1.437 -1.296 0 O-C-N 120.738 -1.226 . . . . 1.0 113.185 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.788 0 O-C-N 121.225 -1.162 . . . . 1.0 112.906 -179.625 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.865 0 N-CA-C 113.536 0.174 . . . . 1.0 113.536 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 12.4 t -75.0 -60.79 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.162 0 CA-C-O 124.023 1.868 . . . . 1.0 111.57 -177.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . 0.496 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 8.4 mt -113.13 124.81 70.14 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.27 0 C-N-CA 127.327 2.251 . . . . 1.0 111.13 -168.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -102.1 125.41 48.78 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 106.424 -1.695 . . . . 1.0 106.424 163.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.77 153.53 39.95 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 119.298 3.073 . . . . 1.0 119.298 -157.077 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 13.7 t -123.73 169.56 11.39 Favored 'General case' 0 N--CA 1.437 -1.083 0 N-CA-C 106.217 -1.772 . . . . 1.0 106.217 161.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 4.2 ttt 84.89 26.46 0.07 Allowed 'General case' 0 CA--C 1.498 -1.039 0 C-N-CA 127.844 2.458 . . . . 1.0 107.398 -154.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -158.98 149.44 19.64 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.495 1.518 . . . . 1.0 107.477 -163.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -147.38 28.24 0.99 Allowed 'General case' 0 N--CA 1.434 -1.256 0 CA-C-O 122.894 1.33 . . . . 1.0 110.524 165.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -94.74 3.09 55.46 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 124.327 1.051 . . . . 1.0 109.097 172.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.359 25.8 tt0 . . . . . 0 C--O 1.261 1.67 1 C-N-CA 132.504 4.322 . . . . 1.0 118.888 172.039 . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 112.598 0.592 . . . . 1.0 112.598 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.88 -43.94 91.29 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 114.846 1.424 . . . . 1.0 114.846 173.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 43.42 54.95 5.05 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 118.476 2.769 . . . . 1.0 118.476 169.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . 0.274 15.9 tp10 74.9 123.83 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 126.168 1.787 . . . . 1.0 113.954 -178.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 65.6 tttp -64.6 130.5 94.76 Favored Pre-proline 0 N--CA 1.435 -1.2 0 C-N-CA 125.902 1.681 . . . . 1.0 113.756 -170.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_exo -57.79 121.45 10.04 Favored 'Trans proline' 0 N--CA 1.441 -1.601 0 C-N-CA 123.534 2.823 . . . . 1.0 115.875 169.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -77.62 -36.25 51.86 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.929 1.292 . . . . 1.0 114.131 176.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -70.18 -39.19 75.4 Favored 'General case' 0 N--CA 1.434 -1.237 0 O-C-N 120.356 -1.465 . . . . 1.0 114.081 -176.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.22 -14.53 81.58 Favored Glycine 0 CA--C 1.494 -1.259 0 N-CA-C 117.043 1.577 . . . . 1.0 117.043 -170.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -96.74 142.73 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 C-N-CA 124.621 1.168 . . . . 1.0 110.613 -177.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -128.59 156.0 44.04 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.239 -1.538 . . . . 1.0 109.776 176.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.4 p -99.42 12.66 35.75 Favored 'General case' 0 N--CA 1.437 -1.081 0 C-N-CA 124.929 1.292 . . . . 1.0 113.242 -167.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -59.41 138.78 57.54 Favored 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 115.303 1.594 . . . . 1.0 115.303 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.76 -33.16 75.03 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 126.986 2.114 . . . . 1.0 112.505 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -104.99 66.5 0.76 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 124.736 1.214 . . . . 1.0 112.497 174.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -145.54 133.74 21.64 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 106.254 -1.758 . . . . 1.0 106.254 168.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -65.0 161.8 17.96 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 116.176 1.917 . . . . 1.0 116.176 -179.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 37.0 pt -138.86 160.74 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 126.145 1.778 . . . . 1.0 108.556 -176.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -117.76 144.91 44.87 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 119.179 -2.201 . . . . 1.0 108.035 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.502 HD22 HG21 ' A' ' 34' ' ' ILE . 1.6 pt? -127.43 157.09 40.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 119.219 -2.175 . . . . 1.0 105.433 169.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.7 ptpt -120.41 150.6 40.53 Favored 'General case' 0 N--CA 1.432 -1.369 0 O-C-N 119.498 -2.001 . . . . 1.0 111.482 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -118.44 122.1 68.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 N-CA-C 106.023 -1.843 . . . . 1.0 106.023 177.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.13 131.64 54.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.543 1.137 . . . . 1.0 111.631 -169.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -163.04 -137.9 2.29 Favored Glycine 0 N--CA 1.434 -1.45 0 N-CA-C 109.465 -1.454 . . . . 1.0 109.465 177.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 43.42 45.14 5.23 Favored 'General case' 0 N--CA 1.436 -1.129 0 C-N-CA 128.005 2.522 . . . . 1.0 117.759 162.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 64.28 30.28 13.49 Favored 'General case' 0 N--CA 1.436 -1.167 0 C-N-CA 126.774 2.03 . . . . 1.0 113.61 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.6 19.01 7.64 Favored Glycine 0 N--CA 1.436 -1.306 0 O-C-N 120.891 -1.13 . . . . 1.0 114.557 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.3 m -115.47 144.99 43.02 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-N 119.504 1.652 . . . . 1.0 111.993 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -139.83 144.77 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 C-N-CA 124.247 1.019 . . . . 1.0 111.563 -167.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.42 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.256 0.5 OUTLIER -129.14 138.68 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 O-C-N 120.355 -1.466 . . . . 1.0 110.88 168.35 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.01 144.98 46.23 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 124.911 2.291 . . . . 1.0 113.963 -175.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.405 ' CD2' HD13 ' B' ' 967' ' ' ILE . 0.3 OUTLIER -132.96 140.66 47.92 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.806 -1.809 . . . . 1.0 107.338 -165.655 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -108.47 118.51 36.96 Favored 'General case' 0 N--CA 1.434 -1.258 0 C-N-CA 126.415 1.886 . . . . 1.0 111.78 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.515 ' HB ' HD11 ' B' ' 969' ' ' LEU . 9.2 tt -147.91 154.73 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.351 0 CA-C-O 124.954 2.311 . . . . 1.0 110.646 -148.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -117.27 160.29 21.33 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 112.511 -2.131 . . . . 1.0 111.84 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -62.15 -38.13 87.83 Favored 'General case' 0 N--CA 1.437 -1.117 0 N-CA-C 117.4 2.37 . . . . 1.0 117.4 -159.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -74.49 -25.14 59.19 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.346 -1.471 . . . . 1.0 114.36 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.7 m -62.69 127.76 90.79 Favored Pre-proline 0 N--CA 1.436 -1.134 0 C-N-CA 125.885 1.674 . . . . 1.0 114.5 -172.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -69.81 158.47 56.79 Favored 'Trans proline' 0 N--CA 1.441 -1.582 0 C-N-CA 122.895 2.397 . . . . 1.0 113.986 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.439 2.8 pp -59.34 -25.48 64.24 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 114.565 1.32 . . . . 1.0 114.565 177.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.4 t -52.71 -29.03 24.55 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 120.154 -1.592 . . . . 1.0 113.738 171.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.96 -43.28 88.38 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 119.959 -1.713 . . . . 1.0 113.24 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.43 HD13 ' H ' ' A' ' 43' ' ' LEU 0.421 0.0 OUTLIER -70.31 -31.22 68.45 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 171.169 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.6 tpp -60.22 -45.92 91.53 Favored 'General case' 0 CA--C 1.497 -1.084 0 O-C-N 120.466 -1.396 . . . . 1.0 113.132 170.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -43.88 98.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 120.909 -1.12 . . . . 1.0 112.552 172.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.22 79.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.07 1.137 . . . . 1.0 114.07 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -62.7 -44.16 96.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 120.395 -1.44 . . . . 1.0 111.781 173.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.0 m -62.93 -41.86 99.62 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.731 1.213 . . . . 1.0 114.095 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -68.19 -51.32 47.02 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 119.984 -1.697 . . . . 1.0 114.868 173.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.406 ' HD2' HG23 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -72.63 -43.17 63.6 Favored 'General case' 0 CA--C 1.496 -1.116 0 O-C-N 120.049 -1.657 . . . . 1.0 113.749 -173.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -112.46 6.97 18.89 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 123.84 0.856 . . . . 1.0 113.036 -170.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.63 3.04 89.86 Favored Glycine 0 N--CA 1.437 -1.247 0 N-CA-C 118.631 2.212 . . . . 1.0 118.631 162.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.18 166.46 23.21 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 115.746 1.758 . . . . 1.0 115.746 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.1 m -102.25 129.42 48.65 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.549 -1.344 . . . . 1.0 110.455 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -66.55 -21.24 66.16 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 115.681 1.734 . . . . 1.0 115.681 -170.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ptt-85 -77.85 -17.88 56.89 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.75 -1.219 . . . . 1.0 113.462 176.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 -94.79 -16.82 22.68 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 124.392 1.077 . . . . 1.0 112.353 -172.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.5 pt -119.98 141.2 41.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.2 0 C-N-CA 124.647 1.179 . . . . 1.0 110.251 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 154.94 49.04 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 107.001 -1.481 . . . . 1.0 107.001 171.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -113.2 148.67 34.99 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 122.302 1.049 . . . . 1.0 110.98 -171.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 41.2 ptt180 -137.51 158.15 45.01 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.753 -1.217 . . . . 1.0 111.525 177.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -137.52 121.2 17.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.51 -0.922 . . . . 1.0 108.51 174.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t70 56.4 40.35 29.74 Favored 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 126.223 1.809 . . . . 1.0 112.99 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.52 3.43 86.48 Favored Glycine 0 N--CA 1.438 -1.205 0 O-C-N 120.095 -1.628 . . . . 1.0 116.273 -176.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -116.65 139.76 25.93 Favored Pre-proline 0 N--CA 1.435 -1.189 0 CA-C-N 119.548 1.674 . . . . 1.0 110.493 -172.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.65 142.64 32.74 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.78 2.32 . . . . 1.0 112.84 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 pt -117.82 147.07 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 C-N-CA 125.439 1.496 . . . . 1.0 108.849 -178.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -109.18 160.58 15.97 Favored 'General case' 0 CA--C 1.493 -1.221 0 O-C-N 120.755 -1.216 . . . . 1.0 110.849 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -69.84 -14.28 62.67 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 119.157 -2.214 . . . . 1.0 114.969 -177.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 95.8 m -99.34 0.46 42.95 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 124.849 1.26 . . . . 1.0 111.714 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -76.75 168.95 19.19 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 118.275 -2.766 . . . . 1.0 109.87 161.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 10.3 p -152.77 163.62 22.94 Favored Pre-proline 0 CA--C 1.497 -1.09 0 O-C-N 119.69 -1.881 . . . . 1.0 111.035 -155.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -58.4 -32.87 97.19 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 123.516 2.811 . . . . 1.0 115.781 167.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.82 -45.96 55.66 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 122.123 0.963 . . . . 1.0 112.57 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -66.86 -40.66 87.95 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 125.676 1.591 . . . . 1.0 113.423 -176.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -88.24 -8.34 55.41 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 121.123 -0.986 . . . . 1.0 112.272 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 62.88 48.21 4.11 Favored 'General case' 0 N--CA 1.434 -1.237 0 C-N-CA 126.501 1.92 . . . . 1.0 113.65 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 59.4 mtt -61.19 154.2 23.99 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.727 2.011 . . . . 1.0 112.792 170.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -114.26 -178.4 3.36 Favored 'General case' 0 N--CA 1.433 -1.292 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 -172.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.39 10.2 p-10 -55.05 -26.61 38.69 Favored 'General case' 0 N--CA 1.435 -1.225 0 N-CA-C 116.654 2.094 . . . . 1.0 116.654 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -141.27 73.04 1.4 Allowed 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 125.469 1.508 . . . . 1.0 110.27 174.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.19 164.9 24.54 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 116.077 1.881 . . . . 1.0 116.077 -174.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.1 m -131.77 115.39 15.91 Favored 'General case' 0 CA--C 1.495 -1.149 0 C-N-CA 124.439 1.096 . . . . 1.0 111.361 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.4 mm -117.9 140.68 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 C-N-CA 126.84 2.056 . . . . 1.0 108.745 -175.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.92 145.7 37.87 Favored 'General case' 0 N--CA 1.433 -1.301 0 O-C-N 120.139 -1.601 . . . . 1.0 110.02 -166.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.6 t -108.56 135.21 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 124.297 1.039 . . . . 1.0 109.014 -177.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -121.83 136.35 54.93 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 122.678 1.228 . . . . 1.0 109.637 164.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -87.93 132.56 34.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 124.268 1.027 . . . . 1.0 110.413 -173.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 96.8 mm-40 -93.07 176.4 6.43 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 115.593 1.701 . . . . 1.0 115.593 -168.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -112.65 11.48 19.58 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 125.623 1.569 . . . . 1.0 111.014 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 20.4 m -65.23 117.73 8.22 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.769 2.028 . . . . 1.0 114.45 -173.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -65.71 146.59 49.68 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 115.756 1.062 . . . . 1.0 115.756 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.736 0 O-C-N 121.713 -0.875 . . . . 1.0 111.035 179.868 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 CA-C-O 120.128 -0.262 . . . . 1.0 113.211 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . 0.42 HG21 ' CG2' ' A' ' 30' ' ' VAL . 0.3 OUTLIER -74.95 -47.22 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 CA-C-N 119.224 1.512 . . . . 1.0 113.964 171.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . 0.43 HG22 HD23 ' B' ' 969' ' ' LEU . 4.7 mt -112.43 116.32 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-O 121.993 0.901 . . . . 1.0 109.715 -169.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -102.07 103.68 14.27 Favored 'General case' 0 N--CA 1.435 -1.181 0 O-C-N 120.463 -1.398 . . . . 1.0 108.803 174.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.515 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.5 OUTLIER -107.97 151.65 25.52 Favored 'General case' 0 CA--C 1.497 -1.071 0 O-C-N 119.731 -1.856 . . . . 1.0 115.077 -171.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 40.8 p -88.73 -106.66 0.08 Allowed 'General case' 0 N--CA 1.437 -1.108 0 O-C-N 120.498 -1.376 . . . . 1.0 112.312 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.259 0.3 OUTLIER 78.59 -45.98 0.4 Allowed 'General case' 0 CA--C 1.495 -1.164 0 C-N-CA 128.234 2.613 . . . . 1.0 116.49 173.729 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -153.91 163.76 39.52 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 106.392 -1.707 . . . . 1.0 106.392 -161.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . 0.45 ' CG ' ' H ' ' B' ' 974' ' ' GLU . 6.8 t70 50.69 -146.76 0.42 Allowed 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 123.533 1.635 . . . . 1.0 114.323 175.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . 0.45 ' H ' ' CG ' ' B' ' 973' ' ' ASP . 77.2 mt-10 -135.37 -25.95 1.29 Allowed 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 126.755 2.022 . . . . 1.0 110.53 -173.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.26 1.656 0 C-N-CA 126.785 2.034 . . . . 1.0 116.166 -176.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.8 mtt . . . . . 0 N--CA 1.483 1.181 0 CA-C-O 121.127 0.489 . . . . 1.0 112.119 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.08 -42.99 96.77 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.079 1.352 . . . . 1.0 114.321 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -110.52 124.03 51.04 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 106.002 -1.851 . . . . 1.0 106.002 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -146.94 70.38 1.2 Allowed 'General case' 0 N--CA 1.436 -1.154 0 O-C-N 120.199 -1.563 . . . . 1.0 111.963 -170.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -64.72 143.82 98.76 Favored Pre-proline 0 N--CA 1.435 -1.19 0 O-C-N 120.515 -1.366 . . . . 1.0 114.288 171.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -55.85 136.46 74.69 Favored 'Trans proline' 0 N--CA 1.441 -1.559 0 C-N-CA 124.063 3.176 . . . . 1.0 117.308 168.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -158.51 174.87 14.43 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 118.982 0.81 . . . . 1.0 110.365 177.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -61.51 149.16 39.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 116.747 2.129 . . . . 1.0 116.747 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 60.08 -176.31 3.68 Favored Glycine 0 N--CA 1.438 -1.232 0 N-CA-C 117.727 1.851 . . . . 1.0 117.727 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 18.7 t -96.38 124.79 49.28 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.183 0 O-C-N 120.631 -1.511 . . . . 1.0 109.928 -172.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 59.1 pttt -58.82 142.71 49.59 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 116.282 1.956 . . . . 1.0 116.282 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 91.4 m -82.64 94.86 7.64 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 120.612 -1.305 . . . . 1.0 108.761 168.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -149.83 121.92 8.29 Favored 'General case' 0 N--CA 1.433 -1.282 0 C-N-CA 124.8 1.24 . . . . 1.0 108.247 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 53.89 48.01 22.23 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 126.664 1.985 . . . . 1.0 114.355 -176.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 32.3 m120 -121.07 156.34 32.45 Favored 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 124.473 1.109 . . . . 1.0 110.181 -174.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -98.48 -6.87 29.5 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.485 -1.384 . . . . 1.0 113.146 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -84.12 153.99 23.41 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.833 2.453 . . . . 1.0 112.64 165.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.8 pt -133.4 160.74 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.296 0 C-N-CA 129.47 3.108 . . . . 1.0 106.173 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 46.0 m-20 -113.12 144.81 42.01 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 118.885 -2.385 . . . . 1.0 108.185 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.837 HD22 HG21 ' A' ' 34' ' ' ILE . 1.3 pt? -128.37 155.91 43.95 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 105.967 -1.864 . . . . 1.0 105.967 171.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.425 ' HD3' HG21 ' A' ' 29' ' ' VAL . 12.9 ptpt -123.87 150.6 44.42 Favored 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 120.495 -1.378 . . . . 1.0 111.968 172.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -118.93 119.25 60.37 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.178 0 N-CA-C 108.038 -1.097 . . . . 1.0 108.038 177.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.44 130.22 54.23 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 122.389 1.09 . . . . 1.0 113.268 -165.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.38 175.16 31.61 Favored Glycine 0 N--CA 1.433 -1.523 0 CA-C-O 122.882 1.268 . . . . 1.0 111.991 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -76.68 -13.6 60.03 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.388 1.255 . . . . 1.0 114.388 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -88.15 16.64 5.9 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.683 -1.26 . . . . 1.0 113.2 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.63 4.96 89.48 Favored Glycine 0 CA--C 1.493 -1.314 0 O-C-N 120.272 -1.518 . . . . 1.0 115.542 170.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.5 m -119.7 143.43 47.76 Favored 'General case' 0 CA--C 1.492 -1.283 0 CA-C-O 124.777 2.227 . . . . 1.0 111.727 170.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.425 HG21 ' HD3' ' A' ' 21' ' ' LYS . 1.6 p -139.95 147.07 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.546 0 CA-C-N 110.56 -3.018 . . . . 1.0 106.715 -168.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.738 HG22 HG11 ' B' ' 966' ' ' VAL . 0.8 OUTLIER -121.4 133.34 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 O-C-N 120.931 -1.105 . . . . 1.0 109.027 170.761 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.417 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -99.3 160.84 13.98 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.54 3.067 . . . . 1.0 114.583 174.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -145.1 140.54 28.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.297 -2.127 . . . . 1.0 105.526 -175.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -100.22 117.77 35.14 Favored 'General case' 0 N--CA 1.433 -1.311 0 C-N-CA 127.317 2.247 . . . . 1.0 107.657 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.837 HG21 HD22 ' A' ' 20' ' ' LEU . 12.3 tt -146.1 154.87 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.281 0 C-N-CA 127.937 2.495 . . . . 1.0 111.33 -151.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.73 167.54 13.34 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 113.595 -1.638 . . . . 1.0 113.705 -174.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -66.57 -38.21 86.59 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 116.989 2.218 . . . . 1.0 116.989 -162.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -87.11 -27.78 22.9 Favored 'General case' 0 CA--C 1.494 -1.175 0 O-C-N 120.2 -1.562 . . . . 1.0 111.226 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 93.6 m -57.75 111.99 4.19 Favored Pre-proline 0 N--CA 1.436 -1.13 0 C-N-CA 127.834 2.454 . . . . 1.0 113.686 -176.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -67.47 163.19 35.75 Favored 'Trans proline' 0 N--CA 1.441 -1.607 0 C-N-CA 124.055 3.17 . . . . 1.0 116.081 -172.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.45 2.5 pp -64.74 -25.59 68.0 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.087 1.514 . . . . 1.0 115.087 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 97.3 p -52.68 -29.1 24.68 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.876 -1.765 . . . . 1.0 114.915 168.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.18 -43.92 80.96 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.214 -1.554 . . . . 1.0 112.094 -177.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.424 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -68.4 -35.59 77.88 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.555 -1.341 . . . . 1.0 113.568 171.635 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.3 ttm -60.59 -43.65 97.14 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 120.318 -1.488 . . . . 1.0 114.207 176.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -66.72 -39.44 88.02 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.517 -1.364 . . . . 1.0 112.971 174.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.91 82.66 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.249 -1.532 . . . . 1.0 114.392 177.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -58.54 -43.85 89.39 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 126.542 1.937 . . . . 1.0 110.863 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.9 m -62.01 -41.75 98.42 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 120.332 -1.48 . . . . 1.0 114.055 174.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -67.15 -47.71 70.22 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 114.707 1.373 . . . . 1.0 114.707 175.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -73.14 -43.25 61.89 Favored 'General case' 0 CA--C 1.495 -1.15 0 N-CA-C 115.892 1.812 . . . . 1.0 115.892 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -112.49 4.17 17.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 121.611 -0.68 . . . . 1.0 112.051 -164.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.49 24.37 47.03 Favored Glycine 0 CA--C 1.494 -1.272 0 N-CA-C 117.403 1.721 . . . . 1.0 117.403 159.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.3 mt -103.7 166.88 10.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 124.773 1.229 . . . . 1.0 112.733 -171.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.9 m -101.91 133.19 47.07 Favored 'General case' 0 CA--C 1.496 -1.13 0 O-C-N 120.552 -1.342 . . . . 1.0 110.08 171.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 20.5 ptp -66.45 -25.42 66.72 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 115.499 1.666 . . . . 1.0 115.499 -170.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 ptt-85 -87.05 -1.62 58.01 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.281 -1.512 . . . . 1.0 112.783 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -102.82 -4.73 24.47 Favored 'General case' 0 N--CA 1.433 -1.297 0 O-C-N 120.893 -1.129 . . . . 1.0 111.792 177.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.6 pt -118.95 142.37 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 O-C-N 120.69 -1.256 . . . . 1.0 111.326 175.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -138.16 143.85 40.48 Favored 'General case' 0 N--CA 1.434 -1.268 0 O-C-N 120.246 -1.534 . . . . 1.0 107.542 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -105.65 145.16 31.39 Favored 'General case' 0 N--CA 1.433 -1.318 0 O-C-N 121.102 -0.999 . . . . 1.0 109.346 -175.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -120.84 152.61 38.18 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.462 1.125 . . . . 1.0 109.838 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -127.99 119.23 25.05 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 106.261 -1.755 . . . . 1.0 106.261 162.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.8 t70 52.68 45.99 27.59 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.075 1.35 . . . . 1.0 113.615 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.73 3.92 87.58 Favored Glycine 0 N--CA 1.435 -1.406 0 N-CA-C 117.823 1.889 . . . . 1.0 117.823 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -121.38 144.63 40.47 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 120.762 2.281 . . . . 1.0 109.039 176.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -68.04 149.65 77.17 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 122.785 2.03 . . . . 1.0 113.701 176.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.9 pt -116.84 141.97 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.258 0 N-CA-C 106.012 -1.847 . . . . 1.0 106.012 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -112.64 171.26 7.63 Favored 'General case' 0 N--CA 1.433 -1.287 0 O-C-N 120.481 -1.387 . . . . 1.0 109.842 -162.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -73.53 -16.77 61.27 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.428 -2.045 . . . . 1.0 113.131 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.7 m -83.54 -13.88 53.51 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 125.15 1.38 . . . . 1.0 112.436 167.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -77.36 167.37 21.8 Favored 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.087 -2.258 . . . . 1.0 111.208 168.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.0 p -154.78 160.4 30.95 Favored Pre-proline 0 CA--C 1.496 -1.103 0 O-C-N 120.057 -1.652 . . . . 1.0 109.873 -160.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.1 -41.17 26.91 Favored 'Trans proline' 0 N--CA 1.441 -1.575 0 C-N-CA 124.352 3.368 . . . . 1.0 116.328 161.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.09 88.1 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 114.489 1.292 . . . . 1.0 114.489 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -71.42 -38.4 71.4 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.323 1.449 . . . . 1.0 113.014 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.5 tp -94.57 -1.93 52.43 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 121.088 -1.008 . . . . 1.0 112.905 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 55.29 48.22 19.74 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 126.495 1.918 . . . . 1.0 114.915 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.6 mtt -62.2 144.12 55.89 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 126.136 1.774 . . . . 1.0 113.758 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -92.49 176.33 6.5 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 122.354 1.073 . . . . 1.0 112.473 -174.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.258 9.3 p-10 -56.57 -26.52 55.44 Favored 'General case' 0 N--CA 1.433 -1.277 0 C-N-CA 127.832 2.453 . . . . 1.0 115.144 172.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -138.39 75.36 1.52 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 125.185 1.394 . . . . 1.0 108.123 166.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.76 157.22 31.79 Favored 'General case' 0 N--CA 1.436 -1.145 0 O-C-N 119.668 -1.895 . . . . 1.0 113.696 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.9 m -125.62 115.25 19.84 Favored 'General case' 0 CA--C 1.495 -1.147 0 CA-C-O 121.905 0.86 . . . . 1.0 110.314 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.3 mm -122.02 140.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.172 0 C-N-CA 127.548 2.339 . . . . 1.0 108.747 -172.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -110.91 147.02 35.52 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.855 -1.778 . . . . 1.0 109.578 -163.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 59.8 t -108.53 129.33 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.22 0 O-C-N 121.002 -1.062 . . . . 1.0 109.865 -175.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -118.71 138.88 52.33 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 122.97 1.367 . . . . 1.0 110.701 163.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -87.19 142.37 27.96 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 121.15 -0.969 . . . . 1.0 112.764 -175.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -134.86 164.32 27.83 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.199 -0.938 . . . . 1.0 110.785 -169.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -131.98 160.49 35.68 Favored 'General case' 0 N--CA 1.435 -1.207 0 C-N-CA 124.539 1.135 . . . . 1.0 109.148 -174.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 41.2 p -136.94 -27.45 1.0 Allowed 'General case' 0 N--CA 1.437 -1.076 0 O-C-N 121.025 -1.047 . . . . 1.0 112.967 178.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.37 8.67 87.62 Favored Glycine 0 N--CA 1.436 -1.33 0 O-C-N 120.024 -1.673 . . . . 1.0 113.565 -169.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.701 0 N-CA-C 108.171 -1.972 . . . . 1.0 108.171 -179.047 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.917 0 N-CA-C 115.076 0.79 . . . . 1.0 115.076 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . 0.738 HG11 HG22 ' A' ' 30' ' ' VAL . 31.1 t -96.41 -100.33 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 C-N-CA 124.456 1.102 . . . . 1.0 113.199 -176.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . 0.46 HG13 HG12 ' B' ' 966' ' ' VAL . 1.2 mt -94.41 123.94 46.71 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 O-C-N 121.053 -1.029 . . . . 1.0 108.501 -159.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -101.98 107.1 18.13 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 120.183 -1.573 . . . . 1.0 107.033 172.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.461 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.3 pp -108.02 153.17 23.49 Favored 'General case' 0 N--CA 1.437 -1.077 0 O-C-N 120.219 -1.55 . . . . 1.0 112.824 -172.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 6.4 m -132.57 131.48 41.55 Favored 'General case' 0 CA--C 1.494 -1.179 0 N-CA-C 107.266 -1.383 . . . . 1.0 107.266 -173.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 12.8 ttt -149.22 -68.13 0.21 Allowed 'General case' 0 CA--C 1.489 -1.402 0 O-C-N 120.914 -1.116 . . . . 1.0 111.534 177.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -123.27 -75.9 0.59 Allowed 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.522 -0.763 . . . . 1.0 109.548 -165.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.13 140.86 51.94 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 124.648 1.179 . . . . 1.0 112.302 -171.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.33 -43.79 79.38 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 116.308 1.966 . . . . 1.0 116.308 -166.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.252 32.5 tt0 . . . . . 0 N--CA 1.425 -1.702 0 C-N-CA 127.676 2.391 . . . . 1.0 114.022 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 113.622 0.971 . . . . 1.0 113.622 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.02 -45.77 73.08 Favored 'General case' 0 N--CA 1.434 -1.246 0 O-C-N 120.544 -1.348 . . . . 1.0 113.293 167.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -70.48 141.22 52.01 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 124.462 1.105 . . . . 1.0 112.751 174.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -87.79 -39.13 15.14 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.136 -1.603 . . . . 1.0 111.003 171.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -64.74 143.59 98.75 Favored Pre-proline 0 N--CA 1.435 -1.212 0 O-C-N 120.858 -1.151 . . . . 1.0 112.987 175.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -75.31 155.6 41.53 Favored 'Trans proline' 0 N--CA 1.44 -1.649 0 C-N-CA 122.572 2.181 . . . . 1.0 112.186 -175.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -66.16 149.83 49.69 Favored 'General case' 0 N--CA 1.435 -1.225 0 C-N-CA 124.313 1.045 . . . . 1.0 113.491 176.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -124.18 136.8 54.45 Favored 'General case' 0 N--CA 1.434 -1.275 0 C-N-CA 124.39 1.076 . . . . 1.0 110.516 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.27 1.35 90.41 Favored Glycine 0 CA--C 1.493 -1.333 0 O-C-N 120.552 -1.342 . . . . 1.0 114.743 176.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 66.8 t -68.43 -41.19 83.18 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 C-N-CA 125.087 1.355 . . . . 1.0 110.672 171.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -123.74 -43.04 2.15 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 122.417 1.104 . . . . 1.0 112.215 174.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 54.9 p -153.85 160.71 42.29 Favored 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 125.647 1.579 . . . . 1.0 110.845 -174.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.432 ' CD ' ' H ' ' A' ' 13' ' ' GLU . 0.8 OUTLIER -70.95 150.31 45.81 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 124.991 1.317 . . . . 1.0 113.234 166.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -107.76 162.39 14.03 Favored 'General case' 0 N--CA 1.436 -1.155 0 C-N-CA 124.972 1.309 . . . . 1.0 109.453 -177.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -134.65 115.81 14.23 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.39 -1.444 . . . . 1.0 108.519 178.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -158.92 162.98 36.93 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-O 124.527 2.108 . . . . 1.0 110.976 -177.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -126.71 163.51 23.34 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 129.788 3.235 . . . . 1.0 113.098 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.6 pt -136.37 160.63 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 C-N-CA 128.53 2.732 . . . . 1.0 106.343 175.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -117.66 144.7 44.96 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 119.641 -1.912 . . . . 1.0 106.589 169.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -134.47 154.55 51.35 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.392 -1.443 . . . . 1.0 107.142 174.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 ptpt -120.0 148.23 43.81 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.071 1.748 . . . . 1.0 111.354 175.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 20.2 t -119.98 122.93 69.79 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.278 0 N-CA-C 107.783 -1.192 . . . . 1.0 107.783 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.57 130.17 55.01 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 124.615 1.166 . . . . 1.0 111.883 -172.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -97.56 -173.39 33.68 Favored Glycine 0 N--CA 1.437 -1.294 0 CA-C-O 122.746 1.192 . . . . 1.0 114.756 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -75.95 -16.02 60.07 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 120.747 -1.443 . . . . 1.0 114.704 -166.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 59.1 p30 -100.72 5.07 43.57 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 124.9 1.28 . . . . 1.0 112.352 175.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.05 5.14 87.92 Favored Glycine 0 N--CA 1.436 -1.319 0 C-N-CA 124.885 1.231 . . . . 1.0 115.648 -179.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 m -70.31 132.65 46.01 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 120.74 -1.447 . . . . 1.0 112.248 174.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.3 p -130.01 137.33 56.77 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.16 0 O-C-N 121.166 -0.959 . . . . 1.0 113.421 -170.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -129.26 138.73 53.65 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.862 -1.774 . . . . 1.0 110.169 169.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.69 145.88 47.01 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-O 124.06 1.885 . . . . 1.0 113.77 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -135.83 141.7 44.73 Favored 'General case' 0 N--CA 1.432 -1.353 0 O-C-N 119.81 -1.806 . . . . 1.0 109.254 -166.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.272 26.7 ttpt -107.05 115.89 30.97 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.552 1.941 . . . . 1.0 113.483 -176.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.52 ' HB ' HD11 ' B' ' 969' ' ' LEU . 6.8 tt -148.86 154.62 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.429 0 CA-C-O 123.994 1.854 . . . . 1.0 109.833 -158.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.305 3.7 mppt? -95.89 165.76 12.12 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.316 -1.765 . . . . 1.0 112.48 -172.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.4 mtm180 -63.49 -38.07 89.72 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 115.847 1.795 . . . . 1.0 115.847 -160.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -85.43 -23.97 27.67 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.549 -1.344 . . . . 1.0 112.742 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.8 m -59.12 131.79 87.29 Favored Pre-proline 0 N--CA 1.436 -1.148 0 C-N-CA 126.972 2.109 . . . . 1.0 115.062 -169.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.02 162.05 41.61 Favored 'Trans proline' 0 N--CA 1.442 -1.521 0 C-N-CA 124.097 3.198 . . . . 1.0 115.236 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.384 2.7 pp -66.91 -25.69 66.5 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 124.663 1.185 . . . . 1.0 114.178 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 94.4 p -52.74 -29.17 25.63 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 120.342 -1.474 . . . . 1.0 114.839 170.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.73 -43.53 65.69 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.212 -1.555 . . . . 1.0 112.32 -172.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.445 HD13 ' H ' ' A' ' 43' ' ' LEU 0.359 0.0 OUTLIER -68.09 -31.13 70.53 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.61 -1.306 . . . . 1.0 114.167 168.624 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 9.7 ttt -61.64 -43.43 98.88 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.535 -1.353 . . . . 1.0 114.001 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -67.47 -36.41 81.1 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 120.41 -1.431 . . . . 1.0 113.554 170.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.51 -34.89 77.78 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 119.411 -2.056 . . . . 1.0 114.323 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -61.6 -43.06 99.56 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 126.296 1.839 . . . . 1.0 111.914 170.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 75.4 m -61.51 -43.85 98.13 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.614 -1.304 . . . . 1.0 113.834 171.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -62.35 -51.84 66.02 Favored 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 120.6 -1.313 . . . . 1.0 114.442 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.444 ' HB2' HD11 ' B' ' 967' ' ' ILE . 0.0 OUTLIER -78.47 -43.33 27.39 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 115.132 1.53 . . . . 1.0 115.132 -176.82 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -108.77 4.22 23.43 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 121.206 -0.933 . . . . 1.0 111.448 -166.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.01 4.95 89.74 Favored Glycine 0 CA--C 1.494 -1.278 0 N-CA-C 117.896 1.919 . . . . 1.0 117.896 161.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.7 mt -76.63 160.95 28.96 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.742 1.617 . . . . 1.0 113.833 -173.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.7 m -102.27 131.77 48.63 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 120.426 -1.421 . . . . 1.0 109.138 168.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.9 ptp -66.58 -18.54 65.42 Favored 'General case' 0 N--CA 1.437 -1.113 0 N-CA-C 116.427 2.01 . . . . 1.0 116.427 -173.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -85.61 -8.92 57.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 120.602 -1.312 . . . . 1.0 114.078 173.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.4 mm-40 -82.07 -33.25 29.96 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.634 -1.916 . . . . 1.0 112.453 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.6 pt -113.59 152.68 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 C-N-CA 125.279 1.431 . . . . 1.0 111.119 -174.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -137.69 154.92 49.61 Favored 'General case' 0 N--CA 1.433 -1.291 0 O-C-N 120.511 -1.368 . . . . 1.0 108.055 172.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 -111.3 148.56 32.66 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.662 1.22 . . . . 1.0 110.553 -173.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 53.3 mtm180 -130.26 159.28 37.36 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 122.165 0.983 . . . . 1.0 109.454 178.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -133.8 125.71 29.05 Favored 'General case' 0 N--CA 1.432 -1.345 0 N-CA-C 106.521 -1.659 . . . . 1.0 106.521 163.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 48.35 44.79 20.35 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 126.816 2.046 . . . . 1.0 114.416 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.98 6.83 86.32 Favored Glycine 0 N--CA 1.435 -1.424 0 O-C-N 120.146 -1.596 . . . . 1.0 116.785 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -119.94 148.28 46.27 Favored Pre-proline 0 N--CA 1.436 -1.13 0 CA-C-N 121.14 2.47 . . . . 1.0 109.288 175.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.11 149.72 52.73 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 122.588 2.192 . . . . 1.0 112.328 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.1 pt -120.57 140.41 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 N-CA-C 107.166 -1.42 . . . . 1.0 107.166 174.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.51 164.28 11.75 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.759 -1.213 . . . . 1.0 110.957 -168.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.9 -13.89 60.59 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 119.056 -2.277 . . . . 1.0 113.945 -176.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 m -96.7 1.45 51.01 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 124.6 1.16 . . . . 1.0 111.226 170.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -82.5 172.0 13.5 Favored 'General case' 0 N--CA 1.432 -1.325 0 O-C-N 119.098 -2.251 . . . . 1.0 110.211 171.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 70.5 p -147.98 162.19 32.02 Favored Pre-proline 0 CA--C 1.498 -1.053 0 O-C-N 119.684 -1.885 . . . . 1.0 112.384 -153.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -56.17 -33.62 90.95 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 123.587 2.858 . . . . 1.0 115.879 166.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.88 -45.96 69.63 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 119.573 1.078 . . . . 1.0 113.541 176.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.26 -38.64 71.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 125.638 1.575 . . . . 1.0 113.63 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -93.27 -8.47 42.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 121.014 -1.053 . . . . 1.0 111.669 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 63.87 43.22 5.51 Favored 'General case' 0 N--CA 1.435 -1.219 0 C-N-CA 126.878 2.071 . . . . 1.0 113.763 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 65.5 mtt -62.2 147.0 49.18 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.216 1.807 . . . . 1.0 111.825 175.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -120.41 176.33 5.54 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 108.712 -0.847 . . . . 1.0 108.712 -168.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.276 10.7 p-10 -54.79 -26.54 35.32 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.837 2.055 . . . . 1.0 115.272 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.07 77.19 1.69 Allowed 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.582 1.553 . . . . 1.0 110.073 166.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.69 160.91 22.29 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 119.656 -1.903 . . . . 1.0 114.823 -178.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -133.59 115.57 14.85 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 124.808 1.243 . . . . 1.0 111.059 -178.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 49.6 mm -120.4 140.72 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.027 0 C-N-CA 127.817 2.447 . . . . 1.0 111.049 -171.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -110.86 137.41 48.55 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.92 -1.738 . . . . 1.0 109.907 -162.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -108.65 132.21 57.19 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.246 0 O-C-N 120.774 -1.204 . . . . 1.0 109.63 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -120.4 137.3 54.39 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-O 123.135 1.445 . . . . 1.0 110.223 159.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -96.85 120.4 37.11 Favored 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 120.671 -1.268 . . . . 1.0 110.357 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 -80.08 -45.05 18.94 Favored 'General case' 0 N--CA 1.434 -1.268 0 O-C-N 121.124 -0.985 . . . . 1.0 111.831 -174.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 71.02 113.53 0.05 Allowed 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 126.414 1.886 . . . . 1.0 115.529 171.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 37.2 p -121.17 147.68 45.26 Favored 'General case' 0 CA--C 1.494 -1.207 0 O-C-N 120.236 -1.54 . . . . 1.0 110.393 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.14 -14.32 81.92 Favored Glycine 0 N--CA 1.436 -1.308 0 O-C-N 120.745 -1.222 . . . . 1.0 113.156 175.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.764 0 C-N-CA 126.389 1.947 . . . . 1.0 108.92 169.807 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 N-CA-C 114.178 0.431 . . . . 1.0 114.178 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.295 0.2 OUTLIER -74.81 -50.02 27.21 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 N-CA-C 115.234 1.568 . . . . 1.0 115.234 -171.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . 0.444 HD11 ' HB2' ' A' ' 50' ' ' ARG . 6.3 mt -113.12 115.42 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 124.113 0.965 . . . . 1.0 109.699 -171.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -102.15 101.98 12.37 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.715 1.606 . . . . 1.0 110.897 172.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.52 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.9 OUTLIER -108.24 159.44 16.62 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 118.922 2.934 . . . . 1.0 118.922 -168.226 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 37.3 p -85.33 178.08 7.6 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 128.315 2.646 . . . . 1.0 113.002 170.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.309 21.6 ttt 101.45 123.56 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.142 0 C-N-CA 128.87 2.868 . . . . 1.0 112.504 168.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . 0.319 62.2 m-20 53.21 59.7 4.24 Favored 'General case' 0 N--CA 1.437 -1.092 0 C-N-CA 126.087 1.755 . . . . 1.0 112.392 -163.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -78.38 78.93 4.84 Favored 'General case' 0 N--CA 1.432 -1.369 0 C-N-CA 125.743 1.617 . . . . 1.0 114.409 -167.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -86.9 48.01 1.58 Allowed 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 125.754 1.622 . . . . 1.0 110.167 158.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 . . . . . 0 C--O 1.26 1.637 0 C-N-CA 128.946 2.898 . . . . 1.0 115.581 -172.929 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.6 mmt . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 113.502 0.927 . . . . 1.0 113.502 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.51 -20.67 60.6 Favored 'General case' 0 N--CA 1.434 -1.265 0 O-C-N 120.952 -1.092 . . . . 1.0 113.396 176.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -119.42 134.29 55.29 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 124.779 1.231 . . . . 1.0 109.915 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -64.27 146.79 53.77 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.352 1.461 . . . . 1.0 111.683 169.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.412 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 63.8 pttt -64.64 145.97 98.5 Favored Pre-proline 0 N--CA 1.436 -1.154 0 N-CA-C 115.272 1.582 . . . . 1.0 115.272 -170.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 5' ' ' LYS . 53.3 Cg_exo -59.15 161.7 15.65 Favored 'Trans proline' 0 N--CA 1.443 -1.489 0 C-N-CA 123.912 3.075 . . . . 1.0 117.737 -171.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -62.22 -43.99 97.58 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 114.389 1.255 . . . . 1.0 114.389 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -99.8 5.38 45.54 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.63 -1.294 . . . . 1.0 112.307 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 69.74 168.45 6.47 Favored Glycine 0 N--CA 1.436 -1.314 0 N-CA-C 117.335 1.694 . . . . 1.0 117.335 176.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.3 p -66.77 133.24 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 125.058 1.343 . . . . 1.0 114.415 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -110.67 20.31 17.77 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 125.309 1.444 . . . . 1.0 112.635 -171.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.4 p -59.55 151.04 25.36 Favored 'General case' 0 CA--C 1.496 -1.1 0 C-N-CA 126.542 1.937 . . . . 1.0 115.146 176.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -92.57 137.05 32.7 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.927 -1.108 . . . . 1.0 112.069 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -141.02 147.06 38.07 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 120.628 -1.295 . . . . 1.0 107.866 172.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -176.18 33.0 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 113.191 0.812 . . . . 1.0 113.191 -163.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -142.43 141.69 32.26 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 105.844 -1.91 . . . . 1.0 105.844 -178.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.4 p-80 -50.34 140.16 13.92 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 117.272 2.323 . . . . 1.0 117.272 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 27.2 pt -133.26 160.82 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.3 0 C-N-CA 128.732 2.813 . . . . 1.0 107.38 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -110.09 144.92 37.98 Favored 'General case' 0 N--CA 1.434 -1.246 0 O-C-N 118.988 -2.32 . . . . 1.0 108.441 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.71 HD22 HG21 ' A' ' 34' ' ' ILE . 1.5 pt? -127.13 149.79 49.79 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.678 -1.889 . . . . 1.0 106.384 169.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -117.71 148.83 41.64 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 119.74 -1.85 . . . . 1.0 110.629 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.4 t -117.3 127.95 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.271 0 N-CA-C 107.127 -1.434 . . . . 1.0 107.127 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.69 130.13 55.67 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.2 1.0 . . . . 1.0 110.323 176.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -83.12 -177.2 51.85 Favored Glycine 0 N--CA 1.435 -1.427 0 CA-C-O 123.093 1.385 . . . . 1.0 114.096 178.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -64.96 -31.92 73.4 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 125.159 1.384 . . . . 1.0 113.042 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -91.32 7.12 42.48 Favored 'General case' 0 N--CA 1.432 -1.337 0 C-N-CA 125.851 1.66 . . . . 1.0 112.858 -173.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.65 7.38 87.49 Favored Glycine 0 N--CA 1.436 -1.329 0 O-C-N 120.805 -1.184 . . . . 1.0 115.125 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.4 m -85.31 133.39 34.15 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 121.342 -1.093 . . . . 1.0 110.075 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.4 p -139.86 130.78 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.108 0 C-N-CA 124.158 0.983 . . . . 1.0 112.611 -166.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -129.24 138.82 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 119.947 -1.72 . . . . 1.0 112.174 173.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.45 147.95 34.16 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-O 125.052 2.358 . . . . 1.0 115.488 175.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -132.95 140.62 47.91 Favored 'General case' 0 N--CA 1.432 -1.365 0 O-C-N 119.523 -1.985 . . . . 1.0 107.862 -170.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -104.56 118.96 37.88 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 126.318 1.847 . . . . 1.0 109.368 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.71 HG21 HD22 ' A' ' 20' ' ' LEU . 12.8 tt -148.46 154.81 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.317 0 CA-C-O 125.238 2.447 . . . . 1.0 111.537 -151.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -104.97 160.35 15.1 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 112.844 -1.98 . . . . 1.0 112.201 -176.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 -61.74 -38.08 86.64 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 116.198 1.925 . . . . 1.0 116.198 -166.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -98.52 -9.8 24.45 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 119.982 -1.698 . . . . 1.0 113.654 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 88.9 m -62.05 121.68 67.29 Favored Pre-proline 0 N--CA 1.437 -1.101 0 C-N-CA 125.047 1.339 . . . . 1.0 111.402 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.59 160.23 44.53 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 CA-C-N 123.926 2.438 . . . . 1.0 114.309 -168.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.466 1.5 pp -61.45 -25.59 67.32 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 114.914 1.45 . . . . 1.0 114.914 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 99.0 p -52.77 -29.02 24.98 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.206 -1.559 . . . . 1.0 115.165 169.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.59 -46.98 67.91 Favored 'General case' 0 N--CA 1.437 -1.098 0 O-C-N 120.974 -1.079 . . . . 1.0 111.924 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.408 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -68.64 -31.5 70.69 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.667 -1.271 . . . . 1.0 112.914 174.605 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.6 ttp -59.82 -44.99 93.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.316 -1.49 . . . . 1.0 114.369 175.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -66.33 -38.44 87.68 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.778 -1.201 . . . . 1.0 112.697 174.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.96 -37.96 89.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 114.263 1.209 . . . . 1.0 114.263 174.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.01 -43.27 99.14 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 126.066 1.747 . . . . 1.0 111.902 174.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.3 m -62.17 -44.71 96.0 Favored 'General case' 0 N--CA 1.435 -1.185 0 O-C-N 120.882 -1.136 . . . . 1.0 113.454 174.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -66.3 -49.52 66.78 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 114.17 1.174 . . . . 1.0 114.17 177.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -71.14 -43.29 67.87 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.04 -1.662 . . . . 1.0 115.285 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -115.32 6.35 14.88 Favored 'General case' 0 N--CA 1.434 -1.258 0 O-C-N 121.077 -1.015 . . . . 1.0 112.929 -163.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.02 9.26 84.56 Favored Glycine 0 CA--C 1.493 -1.308 0 N-CA-C 117.153 1.621 . . . . 1.0 117.153 162.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.6 mt -81.89 159.63 23.62 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.553 -1.557 . . . . 1.0 112.32 -175.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.3 m -102.33 134.02 46.31 Favored 'General case' 0 CA--C 1.496 -1.125 0 O-C-N 121.1 -1.0 . . . . 1.0 110.146 172.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 21.7 ptp -66.26 -30.75 71.24 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 115.935 1.828 . . . . 1.0 115.935 -167.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt-85 -78.38 -15.04 59.1 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.348 -1.47 . . . . 1.0 113.455 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -92.07 -12.66 32.48 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.399 1.08 . . . . 1.0 111.756 -174.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -119.71 143.68 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.201 0 C-N-CA 124.34 1.056 . . . . 1.0 109.16 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -137.81 154.94 49.49 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 120.642 -1.286 . . . . 1.0 108.118 172.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -114.22 140.43 48.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 107.991 -1.115 . . . . 1.0 107.991 -162.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 63.8 mtm180 -129.67 149.54 51.38 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 120.822 -1.174 . . . . 1.0 109.191 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -123.53 112.31 17.32 Favored 'General case' 0 N--CA 1.433 -1.301 0 N-CA-C 107.81 -1.182 . . . . 1.0 107.81 160.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.6 t0 56.67 45.15 22.52 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 125.557 1.543 . . . . 1.0 113.974 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.94 1.44 84.88 Favored Glycine 0 N--CA 1.436 -1.309 0 N-CA-C 116.267 1.267 . . . . 1.0 116.267 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.61 125.81 31.87 Favored Pre-proline 0 N--CA 1.435 -1.223 0 CA-C-N 119.243 1.521 . . . . 1.0 108.994 -174.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -54.54 135.28 65.83 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.641 2.894 . . . . 1.0 115.79 169.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.8 pt -119.57 143.01 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -112.25 166.61 11.12 Favored 'General case' 0 CA--C 1.494 -1.2 0 O-C-N 120.407 -1.433 . . . . 1.0 110.995 -164.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -65.74 -21.49 66.52 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 119.825 -1.797 . . . . 1.0 114.755 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.1 m -82.89 -15.57 50.92 Favored 'General case' 0 N--CA 1.437 -1.109 0 C-N-CA 125.147 1.379 . . . . 1.0 112.959 171.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.8 168.75 19.54 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.217 -2.177 . . . . 1.0 112.637 176.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.1 p -148.63 158.81 39.65 Favored Pre-proline 0 CA--C 1.497 -1.08 0 O-C-N 120.179 -1.575 . . . . 1.0 110.68 -157.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -59.72 -30.91 93.25 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.18 2.586 . . . . 1.0 115.523 171.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.53 -46.03 74.01 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-O 122.035 0.921 . . . . 1.0 113.434 174.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -71.11 -42.56 69.13 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.717 1.207 . . . . 1.0 113.906 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -84.54 -8.54 58.88 Favored 'General case' 0 N--CA 1.435 -1.21 0 O-C-N 121.19 -0.944 . . . . 1.0 111.233 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 63.21 48.24 3.76 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 126.584 1.954 . . . . 1.0 112.983 176.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -64.67 148.55 50.77 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 127.201 2.201 . . . . 1.0 112.997 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -101.52 176.89 5.08 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 124.423 1.089 . . . . 1.0 110.069 -173.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.417 14.0 p-10 -60.48 -26.64 66.95 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 116.689 2.107 . . . . 1.0 116.689 -175.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -135.16 90.94 2.68 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.918 1.287 . . . . 1.0 108.442 157.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -81.51 163.57 22.59 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.845 -1.159 . . . . 1.0 114.013 -174.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.1 m -130.75 115.24 16.38 Favored 'General case' 0 CA--C 1.496 -1.098 0 O-C-N 121.307 -0.871 . . . . 1.0 110.337 177.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 47.1 mm -120.12 140.72 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 128.395 2.678 . . . . 1.0 109.452 -171.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -110.86 138.32 47.41 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 119.987 -1.696 . . . . 1.0 108.547 -164.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.4 t -115.56 133.53 61.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-O 122.789 1.28 . . . . 1.0 110.169 177.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -116.18 138.72 51.03 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 125.057 1.343 . . . . 1.0 110.218 169.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -89.11 137.21 32.53 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.884 -1.135 . . . . 1.0 111.874 -173.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -107.66 -155.94 0.57 Allowed 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.499 1.52 . . . . 1.0 110.5 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -62.94 111.19 2.04 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 125.609 1.563 . . . . 1.0 115.122 -176.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 81.2 p -94.58 -9.63 34.56 Favored 'General case' 0 CA--C 1.496 -1.117 0 O-C-N 120.08 -1.638 . . . . 1.0 112.313 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.8 -0.44 84.89 Favored Glycine 0 N--CA 1.436 -1.366 0 O-C-N 120.542 -1.349 . . . . 1.0 115.891 178.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.753 0 C-N-CA 124.736 1.16 . . . . 1.0 111.283 -178.417 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.869 0 CA-C-O 119.853 -0.415 . . . . 1.0 113.009 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.277 0.2 OUTLIER -74.81 -49.1 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.18 0 CA-C-N 120.032 1.916 . . . . 1.0 114.504 -176.214 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.2 mt -112.5 118.59 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 N-CA-C 108.39 -0.967 . . . . 1.0 108.39 -173.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -102.14 108.35 19.72 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 119.982 -1.698 . . . . 1.0 108.857 166.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 3.3 pp -107.95 156.32 19.34 Favored 'General case' 0 N--CA 1.437 -1.101 0 O-C-N 119.766 -1.834 . . . . 1.0 113.471 -170.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . 0.304 7.4 t -92.9 -145.12 0.22 Allowed 'General case' 0 N--CA 1.438 -1.036 0 C-N-CA 124.799 1.24 . . . . 1.0 112.175 178.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.256 23.8 ttt 80.32 103.78 0.07 Allowed 'General case' 0 N--CA 1.437 -1.088 0 C-N-CA 128.362 2.665 . . . . 1.0 115.504 175.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 49.42 -170.07 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.215 0 C-N-CA 130.004 3.321 . . . . 1.0 116.312 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 5.2 t0 75.29 159.73 0.22 Allowed 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 116.952 2.205 . . . . 1.0 116.952 146.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -80.74 115.33 20.18 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.882 -1.136 . . . . 1.0 113.044 -177.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.255 40.8 tt0 . . . . . 0 N--CA 1.426 -1.646 0 C-N-CA 125.51 1.524 . . . . 1.0 114.288 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.5 mmm . . . . . 0 N--CA 1.483 1.197 0 CA-C-O 118.87 -0.586 . . . . 1.0 111.886 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.81 -40.91 97.76 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 121.15 1.795 . . . . 1.0 115.454 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -88.77 144.36 26.29 Favored 'General case' 0 N--CA 1.435 -1.225 0 C-N-CA 123.838 0.855 . . . . 1.0 110.497 168.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -158.55 155.47 28.42 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.999 -1.063 . . . . 1.0 110.428 174.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -64.74 141.12 98.23 Favored Pre-proline 0 N--CA 1.435 -1.214 0 N-CA-C 115.25 1.574 . . . . 1.0 115.25 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -45.77 158.27 0.28 Allowed 'Trans proline' 0 N--CA 1.442 -1.521 1 C-N-CA 125.377 4.051 . . . . 1.0 118.991 164.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -116.5 9.9 14.4 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.426 1.09 . . . . 1.0 113.409 -164.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -60.21 142.65 54.14 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 115.778 1.77 . . . . 1.0 115.778 -174.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -71.77 133.16 20.72 Favored Glycine 0 N--CA 1.437 -1.266 0 O-C-N 120.753 -1.217 . . . . 1.0 115.174 175.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.1 m -121.95 -2.92 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.144 0 C-N-CA 124.513 1.125 . . . . 1.0 112.42 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -104.04 62.1 0.74 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.886 -1.759 . . . . 1.0 109.352 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 35.9 p -99.58 -10.57 21.89 Favored 'General case' 0 CA--C 1.495 -1.167 0 C-N-CA 125.216 1.406 . . . . 1.0 113.607 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 48.59 50.56 16.87 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 117.676 2.473 . . . . 1.0 117.676 166.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -101.07 -7.88 22.82 Favored 'General case' 0 N--CA 1.436 -1.149 0 O-C-N 119.625 -1.922 . . . . 1.0 115.01 -170.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -121.57 141.69 50.84 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.992 -1.068 . . . . 1.0 109.984 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . 0.276 40.8 m-20 -70.66 -40.61 72.92 Favored 'General case' 0 CA--C 1.49 -1.351 0 CA-C-O 124.839 2.257 . . . . 1.0 114.927 -178.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 -65.2 124.32 21.84 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 110.117 -3.22 . . . . 1.0 115.464 168.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.5 pt -143.02 160.83 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 C-N-CA 130.917 3.687 . . . . 1.0 105.991 -177.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -113.74 144.81 42.34 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 118.21 -2.806 . . . . 1.0 107.55 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.786 HD22 HG21 ' A' ' 34' ' ' ILE . 1.0 OUTLIER -133.8 156.6 47.73 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 119.327 -2.108 . . . . 1.0 105.975 173.801 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.38 150.64 50.65 Favored 'General case' 0 N--CA 1.434 -1.26 0 O-C-N 119.809 -1.807 . . . . 1.0 112.524 171.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.1 t -113.02 129.15 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.921 -1.511 . . . . 1.0 106.921 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.37 136.37 54.88 Favored 'General case' 0 N--CA 1.433 -1.324 0 C-N-CA 124.504 1.122 . . . . 1.0 112.453 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 143.91 -143.37 12.15 Favored Glycine 0 CA--C 1.494 -1.277 0 O-C-N 121.06 -1.025 . . . . 1.0 114.719 170.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.8 tm0? 76.2 -65.72 0.3 Allowed 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 127.247 2.219 . . . . 1.0 114.752 172.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -153.57 22.86 0.53 Allowed 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 125.849 1.66 . . . . 1.0 108.555 -175.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.26 24.93 27.71 Favored Glycine 0 CA--C 1.493 -1.3 0 O-C-N 120.927 -1.108 . . . . 1.0 113.939 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.9 t -104.28 128.02 51.99 Favored 'General case' 0 N--CA 1.435 -1.214 0 O-C-N 121.206 -1.173 . . . . 1.0 110.141 -175.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t -125.89 126.81 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 N-CA-C 107.421 -1.326 . . . . 1.0 107.421 175.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.541 ' CG2' HG11 ' B' ' 966' ' ' VAL . 1.1 p -129.16 138.02 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.101 0 O-C-N 121.325 -0.86 . . . . 1.0 111.204 174.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.41 ' HG3' HG23 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -100.98 160.07 14.68 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 126.829 3.204 . . . . 1.0 115.821 171.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -141.92 140.65 32.86 Favored 'General case' 0 N--CA 1.427 -1.61 0 O-C-N 118.954 -2.341 . . . . 1.0 105.174 -175.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.3 ttpt -101.39 117.32 34.7 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.336 -1.477 . . . . 1.0 107.618 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.786 HG21 HD22 ' A' ' 20' ' ' LEU . 6.4 tt -138.54 154.83 27.55 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.418 0 CA-C-O 123.903 1.811 . . . . 1.0 110.09 -151.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -121.91 159.33 27.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.595 -1.639 . . . . 1.0 111.417 -177.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -71.23 -18.68 62.44 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 117.21 2.3 . . . . 1.0 117.21 -164.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 50.0 m80 -81.75 -28.64 33.22 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 119.925 -1.734 . . . . 1.0 112.481 167.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.4 m -66.88 116.16 32.45 Favored Pre-proline 0 N--CA 1.437 -1.088 0 N-CA-C 114.654 1.353 . . . . 1.0 114.654 -166.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -69.42 161.78 44.51 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 123.477 2.785 . . . . 1.0 115.099 -171.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.454 3.0 pp -64.9 -25.63 67.97 Favored 'General case' 0 N--CA 1.435 -1.202 0 N-CA-C 114.582 1.327 . . . . 1.0 114.582 -178.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.5 p -52.85 -29.26 27.01 Favored 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 115.326 1.602 . . . . 1.0 115.326 167.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.19 -46.82 54.69 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.246 -1.534 . . . . 1.0 111.785 -171.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.761 HD13 ' H ' ' A' ' 43' ' ' LEU 0.337 0.0 OUTLIER -70.18 -31.29 68.69 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 113.995 1.109 . . . . 1.0 113.995 174.21 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 52.7 ttm -59.74 -45.85 90.95 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.413 -1.429 . . . . 1.0 113.797 170.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -65.15 -38.22 89.91 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.426 -1.421 . . . . 1.0 113.669 171.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.82 82.03 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 119.994 -1.691 . . . . 1.0 114.219 176.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.59 -41.13 94.08 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.695 1.998 . . . . 1.0 110.677 171.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 67.3 m -64.11 -43.51 95.1 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 120.66 -1.275 . . . . 1.0 113.812 172.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.93 -51.0 62.43 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.384 -1.448 . . . . 1.0 114.295 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -72.63 -43.21 63.53 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.365 -1.459 . . . . 1.0 114.77 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -116.26 12.26 15.34 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 121.799 0.809 . . . . 1.0 112.185 -162.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.38 10.8 85.59 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.411 1.325 . . . . 1.0 116.411 160.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 46.0 mt -80.48 159.95 25.41 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 124.887 1.275 . . . . 1.0 113.321 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 74.6 m -102.27 130.6 49.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.977 -1.077 . . . . 1.0 110.812 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.7 tpt -59.89 -38.27 81.76 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 116.298 1.962 . . . . 1.0 116.298 -165.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.422 ' NH1' HE22 ' A' ' 57' ' ' GLN . 7.7 ptm180 -94.71 1.68 55.51 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 120.705 -1.247 . . . . 1.0 111.993 -176.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.422 HE22 ' NH1' ' A' ' 56' ' ' ARG . 11.6 mp0 -102.17 -8.37 21.4 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 121.086 -1.008 . . . . 1.0 111.126 175.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 pt -116.83 138.12 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.215 0 O-C-N 120.483 -1.386 . . . . 1.0 109.34 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -138.18 154.96 49.12 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 106.675 -1.602 . . . . 1.0 106.675 173.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -115.88 148.74 39.65 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.994 1.378 . . . . 1.0 111.077 -169.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 26.8 ptt180 -136.31 150.16 48.76 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 121.083 -1.011 . . . . 1.0 109.57 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -124.74 109.05 12.63 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.166 -1.79 . . . . 1.0 106.166 173.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . 0.435 38.3 m-20 59.67 -127.04 1.18 Allowed 'General case' 0 N--CA 1.437 -1.101 0 CA-C-O 116.721 -1.609 . . . . 1.0 110.826 -144.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.25 -16.2 53.35 Favored Glycine 0 CA--C 1.495 -1.158 3 C-N-CA 138.983 7.944 . . . . 1.0 118.565 7.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -123.6 129.47 24.84 Favored Pre-proline 0 N--CA 1.435 -1.19 0 CA-C-N 120.11 1.955 . . . . 1.0 109.142 160.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -58.26 135.19 66.56 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.703 2.269 . . . . 1.0 113.048 156.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.6 pt -117.64 138.68 47.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.16 0 CA-C-O 122.142 0.972 . . . . 1.0 108.481 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -112.72 165.99 11.77 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 121.188 -0.945 . . . . 1.0 109.841 -162.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -71.7 -13.83 61.85 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.745 -1.847 . . . . 1.0 113.719 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.5 m -90.23 -7.42 53.56 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 126.295 1.838 . . . . 1.0 111.728 169.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -82.38 165.07 20.61 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 118.387 -2.695 . . . . 1.0 110.661 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 14.7 p -151.22 164.38 20.44 Favored Pre-proline 0 CA--C 1.498 -1.022 0 O-C-N 120.523 -1.361 . . . . 1.0 110.656 -154.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -60.3 -36.0 89.35 Favored 'Trans proline' 0 N--CA 1.441 -1.599 0 C-N-CA 123.044 2.496 . . . . 1.0 113.999 171.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.11 -44.18 80.58 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-O 122.57 1.176 . . . . 1.0 112.574 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -68.77 -45.18 72.04 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 124.453 1.101 . . . . 1.0 113.376 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.8 tp -89.48 -8.4 52.96 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 121.061 -1.024 . . . . 1.0 112.781 -177.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.26 33.0 mt-10 64.35 44.06 4.42 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 127.802 2.441 . . . . 1.0 115.663 176.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 51.7 mtt -57.11 154.24 10.31 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 129.17 2.988 . . . . 1.0 113.771 173.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.439 ' HG3' ' H ' ' A' ' 80' ' ' ASP . 13.4 tp10 -142.19 -176.23 4.74 Favored 'General case' 0 N--CA 1.434 -1.243 0 N-CA-C 106.793 -1.558 . . . . 1.0 106.793 -172.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.439 ' H ' ' HG3' ' A' ' 79' ' ' GLU 0.312 0.9 OUTLIER -53.16 -26.54 17.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.084 2.954 . . . . 1.0 118.628 -165.968 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -140.36 56.36 1.6 Allowed 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 124.784 1.234 . . . . 1.0 110.528 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.45 162.31 25.81 Favored 'General case' 0 N--CA 1.438 -1.044 0 O-C-N 119.608 -1.933 . . . . 1.0 116.057 -174.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.2 m -131.72 118.98 20.7 Favored 'General case' 0 CA--C 1.497 -1.088 0 O-C-N 120.968 -1.082 . . . . 1.0 111.795 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.3 mt -119.27 140.7 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 C-N-CA 126.495 1.918 . . . . 1.0 108.995 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.95 137.38 48.65 Favored 'General case' 0 N--CA 1.434 -1.253 0 O-C-N 120.289 -1.507 . . . . 1.0 108.026 -173.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.1 p -108.58 136.75 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.146 0 O-C-N 120.509 -1.369 . . . . 1.0 109.946 -177.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -122.44 143.55 49.61 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.647 -1.283 . . . . 1.0 108.374 171.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -86.96 135.1 33.41 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.129 0.966 . . . . 1.0 112.15 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 -129.75 168.93 15.78 Favored 'General case' 0 N--CA 1.432 -1.333 0 C-N-CA 125.397 1.479 . . . . 1.0 109.675 -178.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 49.99 47.43 23.32 Favored 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 117.63 2.455 . . . . 1.0 117.63 169.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.1 m -83.94 124.02 30.57 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.359 -1.463 . . . . 1.0 109.708 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 82.18 12.86 80.18 Favored Glycine 0 N--CA 1.437 -1.269 0 O-C-N 120.405 -1.434 . . . . 1.0 114.982 -177.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.801 0 CA-C-N 118.042 0.921 . . . . 1.0 111.477 178.223 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.001 0 N-CA-C 114.181 0.433 . . . . 1.0 114.181 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . 0.541 HG11 ' CG2' ' A' ' 30' ' ' VAL . 9.5 t -90.78 -110.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 O-C-N 120.808 -1.407 . . . . 1.0 112.468 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . 0.403 ' H ' ' HB ' ' B' ' 966' ' ' VAL . 0.9 OUTLIER -86.51 130.39 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 O-C-N 120.433 -1.417 . . . . 1.0 110.437 -155.263 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -102.17 112.34 24.97 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.918 -1.739 . . . . 1.0 109.981 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 56.2 mt -83.18 140.65 32.45 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 119.011 -2.306 . . . . 1.0 116.108 -174.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 77.2 p -95.07 -126.86 0.12 Allowed 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 124.906 1.282 . . . . 1.0 109.715 167.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 21.8 ttt 78.76 -40.29 0.26 Allowed 'General case' 0 N--CA 1.437 -1.095 0 C-N-CA 127.835 2.454 . . . . 1.0 115.508 171.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -154.21 177.13 11.45 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.767 1.627 . . . . 1.0 106.693 173.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -142.63 32.5 1.45 Allowed 'General case' 0 N--CA 1.433 -1.314 0 O-C-N 120.361 -1.462 . . . . 1.0 113.993 -176.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -81.26 91.42 6.2 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.829 -1.17 . . . . 1.0 108.671 167.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 . . . . . 0 C--O 1.262 1.747 0 C-N-CA 127.798 2.439 . . . . 1.0 115.738 -172.098 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.2 mmm . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 110.682 -0.118 . . . . 1.0 110.682 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.4 -11.81 45.06 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.71 -1.868 . . . . 1.0 111.756 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -66.68 -25.43 66.55 Favored 'General case' 0 N--CA 1.433 -1.321 0 C-N-CA 126.892 2.077 . . . . 1.0 114.954 -178.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -95.83 1.91 53.43 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 124.845 1.258 . . . . 1.0 113.057 -176.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -74.09 150.8 88.03 Favored Pre-proline 0 N--CA 1.435 -1.217 0 C-N-CA 125.104 1.362 . . . . 1.0 111.763 170.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.22 140.7 31.21 Favored 'Trans proline' 0 N--CA 1.44 -1.627 0 C-N-CA 122.314 2.009 . . . . 1.0 112.655 178.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -72.56 149.34 44.11 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 122.717 1.246 . . . . 1.0 113.642 174.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.413 ' CD ' ' HD1' ' A' ' 17' ' ' HIS . 17.7 mt-10 -61.52 -40.41 94.52 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 125.516 1.526 . . . . 1.0 113.382 -178.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -49.87 -51.71 28.25 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 125.114 1.34 . . . . 1.0 116.391 168.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.7 t -69.34 -47.15 74.86 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.111 0 O-C-N 121.043 -1.269 . . . . 1.0 112.837 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -65.45 -35.6 81.4 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 126.192 1.797 . . . . 1.0 114.002 -176.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.258 11.3 m 69.03 45.57 0.9 Allowed 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.542 2.337 . . . . 1.0 111.563 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -154.41 152.42 30.15 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.614 -1.304 . . . . 1.0 107.691 177.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -90.22 135.07 33.89 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 121.016 -1.053 . . . . 1.0 111.707 -171.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -127.43 -75.85 0.57 Allowed 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.998 -1.064 . . . . 1.0 109.592 -179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -101.87 -0.3 34.29 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 122.437 1.113 . . . . 1.0 112.993 -168.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.413 ' HD1' ' CD ' ' A' ' 8' ' ' GLU . 68.1 m80 -89.66 144.98 25.56 Favored 'General case' 0 N--CA 1.433 -1.298 0 C-N-CA 127.907 2.483 . . . . 1.0 110.844 162.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.3 pt -143.02 160.84 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 130.488 3.515 . . . . 1.0 104.961 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -109.58 144.79 37.4 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 119.102 -2.249 . . . . 1.0 108.431 166.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.82 HD22 HG21 ' A' ' 34' ' ' ILE . 1.1 pt? -128.2 154.29 45.98 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 119.425 -2.047 . . . . 1.0 105.792 170.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 0.0 OUTLIER -124.07 150.68 44.7 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.701 -1.874 . . . . 1.0 111.756 169.803 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.0 p -110.9 136.78 45.87 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.26 0 O-C-N 121.166 -0.959 . . . . 1.0 108.64 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.17 130.15 53.58 Favored 'General case' 0 N--CA 1.432 -1.34 0 C-N-CA 124.494 1.118 . . . . 1.0 111.945 -174.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.71 -179.53 20.42 Favored Glycine 0 N--CA 1.435 -1.381 0 CA-C-O 122.915 1.286 . . . . 1.0 113.999 -177.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -99.15 3.66 46.61 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 125.238 1.415 . . . . 1.0 111.868 -169.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.8 p-10 -98.95 2.1 46.14 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 125.903 1.681 . . . . 1.0 110.112 167.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.7 9.09 85.12 Favored Glycine 0 N--CA 1.435 -1.38 0 O-C-N 120.553 -1.342 . . . . 1.0 113.429 -173.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.4 p -70.15 145.22 51.68 Favored 'General case' 0 CA--C 1.494 -1.181 0 O-C-N 120.572 -1.546 . . . . 1.0 112.031 175.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p -139.79 127.05 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.239 0 N-CA-C 109.077 -0.712 . . . . 1.0 109.077 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.423 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.311 0.3 OUTLIER -129.36 135.86 60.75 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.105 0 O-C-N 119.692 -1.88 . . . . 1.0 111.164 166.15 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.417 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -110.13 153.98 23.94 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 124.794 2.235 . . . . 1.0 114.377 175.64 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.5 140.53 37.24 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 106.477 -1.675 . . . . 1.0 106.477 -170.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -99.54 118.08 35.33 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 126.191 1.796 . . . . 1.0 107.084 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.82 HG21 HD22 ' A' ' 20' ' ' LEU . 8.7 tt -143.84 154.72 15.85 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.423 0 C-N-CA 126.595 1.958 . . . . 1.0 109.556 -154.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -116.55 161.16 19.57 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 113.172 -1.831 . . . . 1.0 112.399 -173.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.8 tpt180 -61.41 -38.02 85.59 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 125.329 1.452 . . . . 1.0 114.707 -164.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -101.08 14.5 31.76 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 124.373 1.069 . . . . 1.0 113.515 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.2 m -86.45 121.48 72.3 Favored Pre-proline 0 CA--C 1.497 -1.065 0 CA-C-O 116.703 -1.618 . . . . 1.0 109.367 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.31 158.95 41.99 Favored 'Trans proline' 0 C--N 1.307 -1.619 0 CA-C-N 125.653 3.055 . . . . 1.0 115.534 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.403 1.3 pp -63.63 -25.57 68.28 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 125.302 1.441 . . . . 1.0 114.404 179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 82.7 p -52.72 -29.11 25.05 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.501 -1.374 . . . . 1.0 114.222 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -42.69 68.86 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.442 -1.411 . . . . 1.0 111.524 -176.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.67 -37.14 84.17 Favored 'General case' 0 N--CA 1.434 -1.239 0 O-C-N 120.467 -1.396 . . . . 1.0 113.283 171.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.8 ttm -61.94 -42.63 99.33 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 119.83 -1.794 . . . . 1.0 113.872 175.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -43.57 98.45 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.746 1.26 . . . . 1.0 112.326 175.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.71 -38.13 89.94 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 125.506 1.522 . . . . 1.0 113.837 177.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -61.03 -42.38 98.36 Favored 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 125.626 1.57 . . . . 1.0 111.561 172.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 77.2 m -63.57 -43.17 97.8 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.915 -1.116 . . . . 1.0 113.528 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -68.56 -48.78 63.37 Favored 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 124.36 1.064 . . . . 1.0 113.394 177.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -73.6 -43.02 60.76 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 116.537 2.051 . . . . 1.0 116.537 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -112.9 10.15 18.96 Favored 'General case' 0 N--CA 1.434 -1.263 0 O-C-N 120.957 -1.089 . . . . 1.0 111.883 -165.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.0 43.17 10.05 Favored Glycine 0 CA--C 1.494 -1.246 0 N-CA-C 117.869 1.908 . . . . 1.0 117.869 160.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.5 mt -123.3 161.93 23.67 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 121.1 -1.235 . . . . 1.0 110.556 -168.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.8 m -102.23 133.21 47.48 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 120.137 -1.602 . . . . 1.0 111.084 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.5 tpt -58.68 -39.33 80.38 Favored 'General case' 0 N--CA 1.437 -1.112 0 N-CA-C 116.662 2.097 . . . . 1.0 116.662 -167.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -92.57 1.47 57.24 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 120.565 -1.334 . . . . 1.0 112.588 -176.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -100.14 -21.82 15.41 Favored 'General case' 0 N--CA 1.436 -1.168 0 C-N-CA 124.486 1.114 . . . . 1.0 112.601 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.8 pt -112.95 149.66 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 C-N-CA 124.252 1.021 . . . . 1.0 108.947 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.23 154.99 49.07 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.837 -1.164 . . . . 1.0 109.102 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -115.08 147.28 40.38 Favored 'General case' 0 N--CA 1.434 -1.243 0 O-C-N 120.934 -1.104 . . . . 1.0 110.613 -173.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 58.9 mtm180 -130.94 161.06 32.73 Favored 'General case' 0 N--CA 1.433 -1.299 0 O-C-N 121.212 -0.93 . . . . 1.0 110.95 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -131.91 114.52 14.75 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.083 0.468 . . . . 1.0 109.99 164.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.1 t0 53.79 42.36 31.79 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 127.311 2.244 . . . . 1.0 114.066 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.95 0.78 83.27 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 124.978 1.275 . . . . 1.0 115.761 -176.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -99.9 137.6 20.18 Favored Pre-proline 0 N--CA 1.434 -1.242 0 O-C-N 120.337 -1.684 . . . . 1.0 109.53 -177.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.97 137.66 24.57 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 CA-C-N 122.873 2.062 . . . . 1.0 112.127 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 19.4 pt -118.42 140.52 41.66 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.14 0 N-CA-C 106.011 -1.848 . . . . 1.0 106.011 177.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -106.64 161.52 14.57 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.163 -1.585 . . . . 1.0 109.711 -166.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -57.79 -34.97 70.19 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.403 -2.06 . . . . 1.0 115.532 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -78.55 -12.64 60.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.282 1.033 . . . . 1.0 113.145 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -74.04 170.52 15.27 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 119.475 -2.015 . . . . 1.0 111.66 177.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 63.9 p -148.02 162.31 31.51 Favored Pre-proline 0 CA--C 1.499 -0.992 0 O-C-N 119.065 -2.272 . . . . 1.0 112.746 -153.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_exo -55.04 -36.52 92.95 Favored 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 124.389 3.393 . . . . 1.0 115.857 163.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.55 -45.6 89.77 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 119.556 1.071 . . . . 1.0 113.639 174.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -67.61 -44.97 76.78 Favored 'General case' 0 N--CA 1.432 -1.345 0 C-N-CA 124.706 1.202 . . . . 1.0 112.624 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp -90.6 -8.5 49.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 120.527 -1.358 . . . . 1.0 113.15 -176.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 69.48 37.79 1.91 Allowed 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 128.573 2.749 . . . . 1.0 114.675 175.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 52.5 mtt -58.19 152.76 16.4 Favored 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 128.326 2.65 . . . . 1.0 115.593 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.3 178.32 5.42 Favored 'General case' 0 N--CA 1.433 -1.307 0 O-C-N 121.139 -0.976 . . . . 1.0 109.666 -167.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.346 14.3 p-10 -54.38 -26.56 30.92 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 117.246 2.313 . . . . 1.0 117.246 -174.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -136.66 62.03 1.62 Allowed 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.52 1.528 . . . . 1.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.63 166.45 20.71 Favored 'General case' 0 N--CA 1.439 -0.975 0 O-C-N 119.203 -2.186 . . . . 1.0 115.21 -177.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.7 m -133.56 121.56 22.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 O-C-N 121.04 -1.037 . . . . 1.0 110.7 -174.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.2 mm -118.67 140.71 41.42 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.103 0 C-N-CA 126.954 2.102 . . . . 1.0 109.327 -175.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -110.97 141.73 44.04 Favored 'General case' 0 N--CA 1.434 -1.228 0 O-C-N 119.993 -1.692 . . . . 1.0 109.256 -167.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.1 t -108.49 128.97 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.181 0 CA-C-O 122.41 1.1 . . . . 1.0 109.842 -176.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -116.45 139.67 50.2 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 122.742 1.258 . . . . 1.0 111.159 173.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -96.84 120.32 36.96 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 121.254 -0.904 . . . . 1.0 111.81 -167.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -97.9 -26.72 14.57 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.831 -1.168 . . . . 1.0 110.596 174.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -60.26 146.9 42.13 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 124.944 1.298 . . . . 1.0 113.52 160.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 t -153.95 160.12 41.96 Favored 'General case' 0 CA--C 1.495 -1.154 0 N-CA-C 107.142 -1.429 . . . . 1.0 107.142 177.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -55.03 170.37 1.54 Allowed Glycine 0 N--CA 1.437 -1.266 0 N-CA-C 118.098 1.999 . . . . 1.0 118.098 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.679 0 O-C-N 120.602 -1.528 . . . . 1.0 110.394 -177.602 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 CA-C-O 119.846 -0.419 . . . . 1.0 112.787 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . 0.423 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.27 0.2 OUTLIER -74.91 -51.49 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.114 0 CA-C-N 119.772 1.786 . . . . 1.0 114.601 -175.79 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -108.68 116.57 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.211 0 N-CA-C 107.418 -1.327 . . . . 1.0 107.418 -172.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -102.21 110.66 22.68 Favored 'General case' 0 N--CA 1.434 -1.273 0 O-C-N 119.918 -1.739 . . . . 1.0 106.671 167.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.445 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.5 pp -108.03 143.33 36.88 Favored 'General case' 0 CA--C 1.498 -1.057 0 O-C-N 120.048 -1.657 . . . . 1.0 113.621 -170.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 45.5 p -94.09 -106.96 0.13 Allowed 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 125.956 1.702 . . . . 1.0 112.148 -170.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 13.1 ttt 79.12 -60.99 0.35 Allowed 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 128.448 2.699 . . . . 1.0 115.9 174.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -161.67 166.49 26.66 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 103.443 -2.799 . . . . 1.0 103.443 176.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 63.13 39.9 9.48 Favored 'General case' 0 N--CA 1.436 -1.134 0 C-N-CA 127.014 2.126 . . . . 1.0 112.196 -170.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 43.53 -139.83 0.23 Allowed 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 114.415 1.265 . . . . 1.0 114.415 -165.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.277 24.4 tt0 . . . . . 0 C--O 1.26 1.614 0 O-C-N 119.939 -1.726 . . . . 1.0 115.579 170.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 ttt . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 112.29 0.478 . . . . 1.0 112.29 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.04 -44.85 79.17 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 129.039 2.936 . . . . 1.0 112.51 -12.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 55.69 42.06 29.76 Favored 'General case' 0 N--CA 1.435 -1.178 0 C-N-CA 126.283 1.833 . . . . 1.0 113.156 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.99 131.57 48.03 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 125.415 1.486 . . . . 1.0 114.541 -168.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -89.35 137.24 29.21 Favored Pre-proline 0 N--CA 1.432 -1.331 0 C-N-CA 125.038 1.335 . . . . 1.0 109.976 176.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -100.38 60.21 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.555 0 CA-C-N 124.056 2.484 . . . . 1.0 109.864 -161.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 56.65 50.27 13.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 126.29 1.836 . . . . 1.0 114.692 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -67.74 149.29 50.15 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 126.61 1.964 . . . . 1.0 113.94 177.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -79.56 -5.44 89.3 Favored Glycine 0 N--CA 1.437 -1.27 0 N-CA-C 116.834 1.494 . . . . 1.0 116.834 -174.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 32.9 m -60.07 143.46 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 N-CA-C 115.243 1.572 . . . . 1.0 115.243 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.6 mttt 59.45 31.04 20.77 Favored 'General case' 0 CA--C 1.496 -1.101 0 C-N-CA 127.354 2.262 . . . . 1.0 114.215 177.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.5 m 62.76 37.61 12.39 Favored 'General case' 0 N--CA 1.437 -1.087 0 C-N-CA 127.752 2.421 . . . . 1.0 111.038 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 60.62 45.58 10.25 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.475 1.91 . . . . 1.0 114.614 -176.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -138.5 171.32 14.53 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 125.401 1.48 . . . . 1.0 107.341 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -140.09 176.77 8.48 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.553 -1.342 . . . . 1.0 110.18 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -86.89 23.28 1.77 Allowed 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 115.302 1.593 . . . . 1.0 115.302 -161.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -76.59 133.11 39.75 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.337 -1.477 . . . . 1.0 114.526 174.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.2 pt -142.95 160.82 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.299 1 C-N-CA 131.893 4.077 . . . . 1.0 106.096 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -113.89 144.93 42.22 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 117.722 -3.111 . . . . 1.0 110.112 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.693 HD22 HG21 ' A' ' 34' ' ' ILE . 1.0 OUTLIER -129.95 148.51 51.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 119.036 -2.29 . . . . 1.0 107.689 171.207 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 8.6 ptpt -115.03 150.63 35.58 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 119.478 -2.014 . . . . 1.0 111.63 169.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.8 p -119.59 131.57 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.261 0 O-C-N 121.062 -1.023 . . . . 1.0 108.822 175.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.62 130.25 51.26 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 122.791 1.281 . . . . 1.0 112.654 -175.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -87.06 -176.3 49.11 Favored Glycine 0 N--CA 1.435 -1.429 0 CA-C-O 123.328 1.516 . . . . 1.0 115.572 -177.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -82.7 -10.92 58.7 Favored 'General case' 0 N--CA 1.435 -1.224 0 O-C-N 120.864 -1.374 . . . . 1.0 113.599 -173.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -99.36 2.16 45.03 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 121.244 -0.91 . . . . 1.0 110.868 167.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 86.7 5.57 81.36 Favored Glycine 0 CA--C 1.493 -1.284 0 O-C-N 119.929 -1.732 . . . . 1.0 115.633 177.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.1 m -70.23 139.46 52.24 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 121.035 -1.274 . . . . 1.0 111.35 172.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.3 p -139.74 136.18 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-O 121.71 0.767 . . . . 1.0 112.031 -166.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -129.21 138.74 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 O-C-N 119.722 -1.861 . . . . 1.0 110.842 167.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -113.68 146.4 39.87 Favored 'General case' 0 CA--C 1.496 -1.123 0 CA-C-O 124.688 2.185 . . . . 1.0 114.138 176.103 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -131.54 140.62 49.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.827 -1.796 . . . . 1.0 107.591 -170.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -100.34 116.54 32.55 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 125.231 1.412 . . . . 1.0 109.491 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.693 HG21 HD22 ' A' ' 20' ' ' LEU . 11.3 tt -141.73 154.85 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.39 0 C-N-CA 128.167 2.587 . . . . 1.0 110.11 -152.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.55 164.28 14.54 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 112.974 -1.921 . . . . 1.0 112.448 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -67.28 -38.07 84.47 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 115.081 1.512 . . . . 1.0 115.081 -165.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -98.11 31.09 2.84 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 124.861 1.264 . . . . 1.0 112.08 174.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.4 m -114.65 111.68 45.99 Favored Pre-proline 0 N--CA 1.436 -1.153 0 O-C-N 120.585 -1.322 . . . . 1.0 107.596 176.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -62.04 160.17 31.18 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 123.98 3.12 . . . . 1.0 116.432 -172.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.378 2.0 pp -63.89 -25.65 68.25 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-O 122.941 1.353 . . . . 1.0 114.15 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 t -52.51 -29.21 23.95 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 125.289 1.435 . . . . 1.0 113.896 169.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -66.75 -44.04 82.52 Favored 'General case' 0 N--CA 1.434 -1.255 0 O-C-N 120.124 -1.61 . . . . 1.0 112.876 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.08 -32.2 70.15 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.493 -1.379 . . . . 1.0 113.101 174.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.0 ttm -60.59 -44.43 96.26 Favored 'General case' 0 N--CA 1.436 -1.172 0 O-C-N 120.277 -1.514 . . . . 1.0 114.175 173.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -66.15 -38.25 87.67 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.566 -1.333 . . . . 1.0 113.339 172.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.93 85.31 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 120.179 -1.575 . . . . 1.0 114.048 175.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -62.55 -41.6 99.0 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 125.846 1.658 . . . . 1.0 112.257 174.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.5 -44.02 97.4 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 125.467 1.507 . . . . 1.0 113.014 171.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -64.9 -50.01 68.21 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.32 -1.487 . . . . 1.0 114.101 176.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -77.04 -43.34 34.92 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 115.345 1.609 . . . . 1.0 115.345 -177.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.4 mm100 -113.44 -0.45 14.45 Favored 'General case' 0 N--CA 1.433 -1.317 0 O-C-N 120.899 -1.125 . . . . 1.0 112.013 -165.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.26 2.69 89.15 Favored Glycine 0 CA--C 1.493 -1.283 0 N-CA-C 117.713 1.845 . . . . 1.0 117.713 164.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.6 mt -75.45 153.21 37.74 Favored 'General case' 0 N--CA 1.433 -1.31 0 O-C-N 120.856 -1.379 . . . . 1.0 111.993 -170.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.2 m -99.32 127.73 45.37 Favored 'General case' 0 N--CA 1.433 -1.298 0 O-C-N 120.724 -1.235 . . . . 1.0 109.442 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.6 ptp -66.53 -20.79 66.11 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.036 -1.665 . . . . 1.0 115.133 -174.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ptt85 -75.75 -11.07 59.92 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 124.57 1.148 . . . . 1.0 114.019 170.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -109.38 -8.37 15.07 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.336 -1.477 . . . . 1.0 113.594 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.1 pt -128.49 150.19 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.16 0 O-C-N 120.128 -1.607 . . . . 1.0 109.99 -178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.24 150.0 46.29 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 107.959 -1.126 . . . . 1.0 107.959 170.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -108.38 144.58 35.76 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 121.206 -0.934 . . . . 1.0 109.676 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -134.13 159.1 41.9 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 122.48 1.133 . . . . 1.0 111.24 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -139.1 123.55 18.29 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 108.048 -1.094 . . . . 1.0 108.048 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.2 t70 56.27 38.39 29.74 Favored 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 126.211 1.804 . . . . 1.0 113.351 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.28 2.73 84.42 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 116.287 1.275 . . . . 1.0 116.287 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -116.13 140.62 26.6 Favored Pre-proline 0 N--CA 1.435 -1.196 0 CA-C-N 120.094 1.947 . . . . 1.0 109.642 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -48.82 135.3 28.5 Favored 'Trans proline' 0 C--N 1.308 -1.589 0 C-N-CA 124.155 3.237 . . . . 1.0 117.245 169.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 11.1 pt -117.93 138.19 49.41 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.242 0 N-CA-C 106.329 -1.73 . . . . 1.0 106.329 169.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -104.12 167.14 9.95 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 121.096 -1.003 . . . . 1.0 109.887 -162.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -78.14 -16.54 57.85 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.032 -2.293 . . . . 1.0 111.259 -176.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.21 -13.83 59.45 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 130.959 3.703 . . . . 1.0 113.607 167.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -86.08 169.61 12.99 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 119.639 -1.913 . . . . 1.0 111.361 171.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 19.2 p -151.51 161.15 30.47 Favored Pre-proline 0 CA--C 1.496 -1.1 0 O-C-N 120.201 -1.562 . . . . 1.0 110.612 -158.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -58.42 -31.56 94.34 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 C-N-CA 123.846 3.031 . . . . 1.0 115.32 167.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.44 -46.07 74.2 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 119.544 1.065 . . . . 1.0 113.033 172.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -69.31 -37.73 77.91 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 124.499 1.12 . . . . 1.0 113.755 -176.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 13.5 tp -95.18 -0.63 53.03 Favored 'General case' 0 N--CA 1.434 -1.262 0 O-C-N 120.807 -1.183 . . . . 1.0 111.86 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 56.15 42.61 28.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 127.541 2.336 . . . . 1.0 115.86 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.8 mtt -59.84 149.42 31.41 Favored 'General case' 0 N--CA 1.434 -1.275 0 C-N-CA 127.126 2.17 . . . . 1.0 113.748 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -109.67 -172.38 2.03 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 121.358 -0.839 . . . . 1.0 109.113 -165.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.363 14.0 p-10 -60.21 -26.47 66.42 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.045 -1.659 . . . . 1.0 115.119 176.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -143.61 87.51 1.94 Allowed 'General case' 0 N--CA 1.436 -1.165 0 C-N-CA 124.416 1.087 . . . . 1.0 110.426 170.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.44 169.29 11.19 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 114.794 1.405 . . . . 1.0 114.794 178.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.3 m -136.45 123.13 21.06 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 124.874 1.269 . . . . 1.0 109.822 -175.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 46.8 mm -121.47 140.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 C-N-CA 126.297 1.839 . . . . 1.0 108.883 -175.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -110.91 141.76 43.9 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.049 -1.657 . . . . 1.0 108.891 -171.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -108.59 139.63 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.142 0 O-C-N 120.522 -1.361 . . . . 1.0 109.542 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -124.45 137.46 54.44 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 122.206 1.003 . . . . 1.0 108.959 167.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -81.88 133.3 35.31 Favored 'General case' 0 N--CA 1.435 -1.201 0 C-N-CA 124.355 1.062 . . . . 1.0 112.228 -174.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -131.37 173.5 11.01 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 124.972 1.309 . . . . 1.0 111.029 -174.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -148.94 -14.16 0.31 Allowed 'General case' 0 N--CA 1.434 -1.225 0 N-CA-C 115.431 1.641 . . . . 1.0 115.431 -176.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 75.9 p -100.23 7.15 44.66 Favored 'General case' 0 CA--C 1.497 -1.077 0 O-C-N 119.508 -1.995 . . . . 1.0 114.492 -175.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -81.36 -4.68 90.39 Favored Glycine 0 CA--C 1.494 -1.263 0 N-CA-C 116.877 1.511 . . . . 1.0 116.877 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.683 0 O-C-N 120.806 -1.408 . . . . 1.0 110.916 -179.692 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.914 0 N-CA-C 114.076 0.39 . . . . 1.0 114.076 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.272 0.2 OUTLIER -74.86 -48.25 34.02 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.137 0 O-C-N 120.235 -1.744 . . . . 1.0 115.145 -172.439 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.1 mt -110.53 123.88 66.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 C-N-CA 124.218 1.007 . . . . 1.0 108.97 -170.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -102.14 105.63 16.36 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.52 -1.362 . . . . 1.0 108.294 165.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 34' ' ' ILE . 3.9 pp -108.04 161.34 15.04 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.624 -1.297 . . . . 1.0 113.022 -178.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 12.0 t -122.68 -177.48 3.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.063 1.345 . . . . 1.0 109.805 178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.322 40.6 ttp 116.52 92.3 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.103 0 C-N-CA 130.069 3.348 . . . . 1.0 115.472 168.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 41.6 p-10 -173.68 -54.7 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.108 0 C-N-CA 126.58 1.952 . . . . 1.0 110.586 169.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -152.95 20.51 0.59 Allowed 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 127.076 2.151 . . . . 1.0 108.661 -174.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . 0.268 11.1 tp10 67.96 -81.21 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.258 0 C-N-CA 128.477 2.711 . . . . 1.0 112.434 -161.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.259 29.8 tt0 . . . . . 0 C--O 1.262 1.727 0 C-N-CA 125.629 1.572 . . . . 1.0 114.91 172.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 120.447 0.165 . . . . 1.0 110.59 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.8 -35.21 74.64 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 120.049 -1.657 . . . . 1.0 114.968 176.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -61.56 146.26 49.38 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 115.042 1.497 . . . . 1.0 115.042 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -124.42 132.82 53.51 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.912 -1.117 . . . . 1.0 111.638 179.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.91 153.02 94.95 Favored Pre-proline 0 N--CA 1.436 -1.145 0 N-CA-C 116.58 2.067 . . . . 1.0 116.58 -175.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -46.16 142.8 8.26 Favored 'Trans proline' 0 N--CA 1.442 -1.516 0 C-N-CA 124.819 3.679 . . . . 1.0 118.64 161.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -84.15 149.29 26.27 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 124.447 1.099 . . . . 1.0 113.52 178.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -157.55 175.23 14.22 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.716 -1.24 . . . . 1.0 111.971 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 78.38 171.56 38.94 Favored Glycine 0 N--CA 1.436 -1.327 0 O-C-N 120.456 -1.403 . . . . 1.0 114.776 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.257 2.9 t 51.96 58.14 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.101 0 C-N-CA 126.82 2.048 . . . . 1.0 114.139 -178.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -88.0 63.16 7.2 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 119.377 -2.077 . . . . 1.0 112.675 -171.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 52.3 p -101.72 6.33 41.77 Favored 'General case' 0 CA--C 1.497 -1.068 0 C-N-CA 127.131 2.173 . . . . 1.0 112.88 -172.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.27 -40.18 93.15 Favored 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 127.443 2.297 . . . . 1.0 115.78 -170.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -137.15 -21.56 1.2 Allowed 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 124.039 0.935 . . . . 1.0 111.676 -175.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -124.45 123.36 39.98 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.603 1.161 . . . . 1.0 108.541 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -156.94 163.97 38.55 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 107.178 -1.415 . . . . 1.0 107.178 -178.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.5 135.42 45.67 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 116.295 1.961 . . . . 1.0 116.295 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.4 pt -138.06 160.78 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.262 0 C-N-CA 129.132 2.973 . . . . 1.0 105.316 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -111.75 144.9 40.27 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 119.252 -2.155 . . . . 1.0 108.832 177.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.613 HD22 HG21 ' A' ' 34' ' ' ILE . 1.3 pt? -129.43 156.13 44.59 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 119.474 -2.016 . . . . 1.0 106.331 170.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.58 150.58 45.77 Favored 'General case' 0 N--CA 1.434 -1.266 0 O-C-N 119.433 -2.042 . . . . 1.0 111.453 166.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 p -118.27 137.95 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.257 0 N-CA-C 108.377 -0.972 . . . . 1.0 108.377 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.88 130.2 49.71 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 121.356 -0.84 . . . . 1.0 112.498 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -149.98 168.02 30.03 Favored Glycine 0 N--CA 1.436 -1.364 0 CA-C-O 122.333 0.963 . . . . 1.0 114.587 -178.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 51.41 29.43 5.23 Favored 'General case' 0 N--CA 1.437 -1.123 0 C-N-CA 128.678 2.791 . . . . 1.0 117.058 175.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 61.65 26.15 15.89 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 126.445 1.898 . . . . 1.0 113.732 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -177.21 -16.68 0.02 OUTLIER Glycine 0 N--CA 1.435 -1.38 0 O-C-N 120.208 -1.558 . . . . 1.0 116.578 -177.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.1 t -90.45 128.12 36.42 Favored 'General case' 0 CA--C 1.494 -1.193 0 O-C-N 120.262 -1.728 . . . . 1.0 109.197 176.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.0 p -138.56 126.78 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 121.89 0.852 . . . . 1.0 108.853 163.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.292 0.3 OUTLIER -129.42 138.75 53.51 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 O-C-N 120.4 -1.437 . . . . 1.0 111.717 173.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.06 149.91 39.52 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 124.058 1.885 . . . . 1.0 115.022 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -142.49 140.58 31.91 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.534 -1.354 . . . . 1.0 108.974 -162.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -104.22 115.84 31.12 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 125.283 1.433 . . . . 1.0 113.172 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.613 HG21 HD22 ' A' ' 20' ' ' LEU . 13.5 tt -141.32 154.72 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-O 124.614 2.15 . . . . 1.0 111.576 -154.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -93.7 153.98 18.05 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 112.272 -2.24 . . . . 1.0 113.504 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 68.9 mtt-85 -69.8 -38.17 76.55 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 115.783 1.772 . . . . 1.0 115.783 -172.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -101.43 33.99 2.74 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.29 -1.506 . . . . 1.0 112.367 -174.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.32 155.11 80.54 Favored Pre-proline 0 CA--C 1.496 -1.114 0 O-C-N 120.601 -1.312 . . . . 1.0 108.119 -173.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -78.12 149.85 25.69 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 CA-C-N 124.241 2.55 . . . . 1.0 114.351 -167.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.336 2.1 pp -61.02 -25.53 66.98 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 125.876 1.67 . . . . 1.0 114.512 172.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 92.3 p -52.7 -29.04 24.54 Favored 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 119.366 -2.083 . . . . 1.0 113.823 171.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HZ2' ' HB3' ' B' ' 971' ' ' MET . 11.3 ttpt -65.33 -40.88 94.27 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.632 -1.293 . . . . 1.0 112.74 -174.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.9 -37.73 84.93 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.609 -1.307 . . . . 1.0 113.686 167.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 54.7 ttm -60.81 -42.12 97.04 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.097 -1.627 . . . . 1.0 113.908 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.83 -43.33 99.09 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.909 -1.119 . . . . 1.0 112.395 174.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.41 83.82 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.528 -1.358 . . . . 1.0 114.477 176.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -60.2 -42.76 95.76 Favored 'General case' 0 N--CA 1.436 -1.161 0 C-N-CA 125.959 1.704 . . . . 1.0 112.033 174.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 74.4 m -62.15 -41.65 98.49 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 124.793 1.237 . . . . 1.0 113.791 176.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -65.99 -47.29 75.04 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 114.289 1.218 . . . . 1.0 114.289 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -75.86 -42.99 47.81 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 116.185 1.92 . . . . 1.0 116.185 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -114.07 11.89 17.78 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.868 -1.145 . . . . 1.0 112.551 -161.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.34 43.71 19.43 Favored Glycine 0 CA--C 1.494 -1.244 0 N-CA-C 117.078 1.591 . . . . 1.0 117.078 164.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.4 mt -124.63 156.5 37.4 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 124.334 1.054 . . . . 1.0 111.154 -169.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.5 m -102.2 131.35 48.79 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.543 -1.348 . . . . 1.0 111.01 170.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -65.02 -24.5 67.52 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 116.317 1.969 . . . . 1.0 116.317 -170.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -89.69 -3.46 58.21 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.258 -1.526 . . . . 1.0 112.848 177.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -100.87 -15.91 17.42 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.715 -1.241 . . . . 1.0 111.849 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.2 pt -114.42 147.09 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.217 0 C-N-CA 125.312 1.445 . . . . 1.0 108.322 174.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -137.75 152.22 48.98 Favored 'General case' 0 N--CA 1.434 -1.255 0 N-CA-C 107.154 -1.424 . . . . 1.0 107.154 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 17.8 m-30 -109.4 148.59 30.87 Favored 'General case' 0 N--CA 1.434 -1.25 0 CA-C-O 123.079 1.418 . . . . 1.0 109.956 -173.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -139.62 140.97 37.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 108.023 -1.103 . . . . 1.0 108.023 -168.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -127.01 115.96 20.02 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.12 -1.437 . . . . 1.0 107.12 171.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t70 59.16 40.11 22.14 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 125.48 1.512 . . . . 1.0 114.117 171.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.71 5.17 90.15 Favored Glycine 0 N--CA 1.438 -1.216 0 N-CA-C 116.173 1.229 . . . . 1.0 116.173 -174.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -117.17 136.67 23.45 Favored Pre-proline 0 N--CA 1.433 -1.278 0 O-C-N 120.291 -1.711 . . . . 1.0 109.97 -173.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -58.51 137.46 80.44 Favored 'Trans proline' 0 N--CA 1.44 -1.631 0 C-N-CA 123.539 2.826 . . . . 1.0 114.558 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.0 pt -117.13 135.68 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 N-CA-C 106.206 -1.776 . . . . 1.0 106.206 171.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -100.59 163.9 12.14 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.363 -1.461 . . . . 1.0 110.232 -165.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.87 -17.55 61.52 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 119.053 -2.279 . . . . 1.0 113.598 -178.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 98.9 m -78.6 -19.78 51.96 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 125.665 1.586 . . . . 1.0 112.53 167.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -76.61 170.7 15.93 Favored 'General case' 0 N--CA 1.432 -1.355 0 O-C-N 119.702 -1.874 . . . . 1.0 112.153 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 77.2 p -149.25 159.07 37.7 Favored Pre-proline 0 CA--C 1.495 -1.154 0 O-C-N 119.861 -1.775 . . . . 1.0 109.556 -158.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -58.04 -35.05 99.04 Favored 'Trans proline' 0 N--CA 1.439 -1.69 0 C-N-CA 123.334 2.689 . . . . 1.0 114.94 168.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.97 83.26 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 113.916 1.08 . . . . 1.0 113.916 176.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -68.94 -42.52 76.62 Favored 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 124.845 1.258 . . . . 1.0 113.56 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -86.01 -8.47 57.93 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 121.926 0.87 . . . . 1.0 111.073 -178.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 66.7 44.35 2.21 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 127.196 2.199 . . . . 1.0 114.259 175.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 60.3 mtt -62.05 154.24 27.38 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 128.598 2.759 . . . . 1.0 113.398 172.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -113.3 178.23 4.35 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 107.981 -1.118 . . . . 1.0 107.981 -169.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.459 10.2 p-10 -54.23 -26.5 28.9 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 117.164 2.283 . . . . 1.0 117.164 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -138.28 58.5 1.67 Allowed 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 125.887 1.675 . . . . 1.0 112.069 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.89 161.61 29.59 Favored 'General case' 0 N--CA 1.438 -1.038 0 N-CA-C 116.233 1.938 . . . . 1.0 116.233 -171.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 61.2 m -129.04 116.42 19.28 Favored 'General case' 0 CA--C 1.497 -1.065 0 C-N-CA 125.011 1.325 . . . . 1.0 111.971 -176.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.7 mm -120.74 140.91 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 C-N-CA 127.974 2.51 . . . . 1.0 109.842 -170.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -110.93 143.86 40.91 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 119.528 -1.983 . . . . 1.0 108.918 -167.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 39.4 t -108.66 126.25 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.214 0 O-C-N 120.955 -1.091 . . . . 1.0 108.762 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -113.6 134.84 54.48 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-O 123.403 1.573 . . . . 1.0 107.543 172.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -106.33 124.65 49.92 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.923 -1.111 . . . . 1.0 110.751 -161.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -108.68 -10.76 15.15 Favored 'General case' 0 N--CA 1.436 -1.157 0 O-C-N 120.777 -1.202 . . . . 1.0 112.597 -174.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -16.65 121.14 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 130.529 3.532 . . . . 1.0 119.483 175.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . 0.28 6.3 m 65.15 53.04 1.39 Allowed 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 126.885 2.074 . . . . 1.0 111.677 -176.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -112.88 -18.83 7.16 Favored Glycine 0 CA--C 1.493 -1.318 0 O-C-N 121.262 -0.899 . . . . 1.0 113.97 -177.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.805 0 CA-C-O 118.393 -1.226 . . . . 1.0 111.425 177.118 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 N-CA-C 113.485 0.154 . . . . 1.0 113.485 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -74.84 -46.6 40.54 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 N-CA-C 115.285 1.587 . . . . 1.0 115.285 -165.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.4 mt -113.08 119.01 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 C-N-CA 125.11 1.364 . . . . 1.0 110.18 -173.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -102.02 115.65 31.0 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.06 -1.65 . . . . 1.0 106.808 165.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.0 166.29 10.83 Favored 'General case' 0 CA--C 1.497 -1.072 0 CA-C-N 121.667 2.031 . . . . 1.0 114.581 -174.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 4.0 t -146.81 179.99 7.19 Favored 'General case' 0 N--CA 1.438 -1.05 0 C-N-CA 124.55 1.14 . . . . 1.0 110.531 -175.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . 0.408 ' HB3' ' HZ2' ' A' ' 42' ' ' LYS . 42.3 ttp 101.72 50.88 0.0 OUTLIER 'General case' 0 CA--C 1.498 -1.043 0 C-N-CA 130.732 3.613 . . . . 1.0 107.728 -156.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -153.97 -10.97 0.14 Allowed 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 114.026 1.121 . . . . 1.0 114.026 -163.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 59.8 -176.76 0.1 Allowed 'General case' 0 N--CA 1.435 -1.177 0 CA-C-O 122.532 1.158 . . . . 1.0 113.329 -155.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.61 134.04 47.25 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 119.453 -2.029 . . . . 1.0 114.164 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.619 0 C-N-CA 125.396 1.478 . . . . 1.0 111.993 177.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 119.302 -0.38 . . . . 1.0 110.771 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.46 7.86 36.67 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 119.616 -1.927 . . . . 1.0 112.946 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.42 -38.04 89.61 Favored 'General case' 0 N--CA 1.433 -1.289 0 C-N-CA 125.88 1.672 . . . . 1.0 114.704 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -122.76 152.22 40.84 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.74 -1.225 . . . . 1.0 109.977 171.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -64.74 152.18 90.81 Favored Pre-proline 0 N--CA 1.435 -1.215 0 C-N-CA 126.743 2.017 . . . . 1.0 113.871 -175.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_exo -44.16 141.85 4.47 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 125.02 3.813 . . . . 1.0 118.223 173.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -65.21 128.12 34.49 Favored 'General case' 0 N--CA 1.436 -1.14 0 N-CA-C 113.068 0.766 . . . . 1.0 113.068 173.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 59.44 37.19 23.19 Favored 'General case' 0 N--CA 1.436 -1.13 0 C-N-CA 126.656 1.982 . . . . 1.0 116.03 -177.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.28 160.13 13.71 Favored Glycine 0 N--CA 1.438 -1.203 0 N-CA-C 117.031 1.572 . . . . 1.0 117.031 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.6 t -122.42 137.22 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.123 0 C-N-CA 124.659 1.184 . . . . 1.0 109.983 -177.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -134.01 171.5 14.11 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 125.441 1.496 . . . . 1.0 108.68 -176.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.8 m -67.35 128.02 34.84 Favored 'General case' 0 N--CA 1.439 -1.018 0 O-C-N 119.983 -1.698 . . . . 1.0 111.137 168.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -107.29 25.19 11.73 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 119.91 -1.743 . . . . 1.0 112.347 -168.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -62.65 -30.85 71.68 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 126.471 1.908 . . . . 1.0 115.496 -176.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -99.76 0.61 42.02 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.604 -1.31 . . . . 1.0 112.48 178.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -91.49 20.39 5.37 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 115.712 1.745 . . . . 1.0 115.712 -160.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 -56.23 145.19 27.29 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 117.141 2.274 . . . . 1.0 117.141 173.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.3 pt -129.57 160.66 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 129.346 3.058 . . . . 1.0 106.153 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.75 144.79 44.98 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.925 -2.985 . . . . 1.0 111.027 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.65 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -131.52 151.38 51.63 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 119.286 -2.134 . . . . 1.0 107.992 170.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 7.5 ptpt -121.38 150.61 41.23 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 119.908 -1.745 . . . . 1.0 110.697 172.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.0 p -116.52 131.9 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 N-CA-C 108.314 -0.995 . . . . 1.0 108.314 174.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.75 132.43 54.61 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 124.759 1.224 . . . . 1.0 111.027 -174.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 160.2 -134.55 3.69 Favored Glycine 0 CA--C 1.49 -1.49 0 N-CA-C 109.236 -1.546 . . . . 1.0 109.236 176.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 38.63 49.84 1.5 Allowed 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 118.252 2.686 . . . . 1.0 118.252 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 70.75 39.76 1.06 Allowed 'General case' 0 N--CA 1.433 -1.302 0 C-N-CA 126.499 1.92 . . . . 1.0 112.453 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.87 23.77 19.55 Favored Glycine 0 CA--C 1.492 -1.345 0 C-N-CA 124.586 1.088 . . . . 1.0 114.022 166.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.6 m -107.86 157.76 17.9 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 125.633 1.573 . . . . 1.0 111.0 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -139.87 137.22 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.143 0 O-C-N 120.523 -1.361 . . . . 1.0 109.501 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.401 ' CG2' HG21 ' B' ' 966' ' ' VAL 0.292 0.3 OUTLIER -129.31 138.72 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.044 0 O-C-N 119.846 -1.784 . . . . 1.0 111.208 166.4 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.407 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -116.31 147.21 41.77 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-O 125.393 2.521 . . . . 1.0 114.425 176.921 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -127.23 140.58 52.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.331 -1.729 . . . . 1.0 106.331 -173.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -101.23 115.85 31.44 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.835 2.454 . . . . 1.0 107.164 176.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.65 HG21 HD22 ' A' ' 20' ' ' LEU . 9.6 tt -137.7 154.72 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 CA-C-O 125.57 2.605 . . . . 1.0 109.362 -155.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 mtpp -108.74 164.16 12.62 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 110.967 -2.833 . . . . 1.0 111.775 -165.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -59.41 -38.01 79.53 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 115.989 1.848 . . . . 1.0 115.989 -160.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 65.2 m-70 -116.65 33.73 5.43 Favored 'General case' 0 N--CA 1.432 -1.35 0 O-C-N 120.958 -1.089 . . . . 1.0 111.759 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.8 m -90.77 124.85 61.1 Favored Pre-proline 0 N--CA 1.438 -1.072 0 O-C-N 120.654 -1.279 . . . . 1.0 109.938 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.73 159.82 52.02 Favored 'Trans proline' 0 N--CA 1.441 -1.615 0 C-N-CA 122.988 2.459 . . . . 1.0 114.615 175.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.359 1.0 OUTLIER -64.99 -25.79 68.01 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 114.805 1.409 . . . . 1.0 114.805 179.841 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.8 p -52.77 -29.24 26.18 Favored 'General case' 0 N--CA 1.437 -1.108 0 O-C-N 120.097 -1.627 . . . . 1.0 115.379 168.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.04 -42.9 68.9 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.042 -1.661 . . . . 1.0 112.572 -175.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.429 HD22 HD21 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -65.77 -35.68 81.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.67 -1.269 . . . . 1.0 113.527 172.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.9 ttm -61.75 -43.1 99.51 Favored 'General case' 0 N--CA 1.435 -1.192 0 O-C-N 120.233 -1.542 . . . . 1.0 113.771 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -42.75 99.3 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 120.926 -1.108 . . . . 1.0 112.969 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.2 86.79 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.515 1.126 . . . . 1.0 113.759 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.38 -42.59 98.96 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 125.574 1.55 . . . . 1.0 112.212 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.2 m -61.88 -43.69 98.34 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.528 1.131 . . . . 1.0 113.525 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.58 -48.66 68.89 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.667 1.358 . . . . 1.0 114.667 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.1 -43.18 62.1 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 119.886 -1.759 . . . . 1.0 115.558 -179.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -113.58 8.95 17.85 Favored 'General case' 0 N--CA 1.434 -1.252 0 O-C-N 121.129 -0.982 . . . . 1.0 112.389 -165.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.63 9.84 85.11 Favored Glycine 0 CA--C 1.494 -1.267 0 N-CA-C 116.815 1.486 . . . . 1.0 116.815 162.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.7 mt -81.61 166.34 20.29 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 125.323 1.449 . . . . 1.0 113.238 -174.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -102.21 139.64 37.56 Favored 'General case' 0 CA--C 1.494 -1.21 0 O-C-N 120.563 -1.336 . . . . 1.0 112.245 170.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -29.25 70.63 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 125.1 1.36 . . . . 1.0 113.484 -178.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.6 ptt180 -95.0 -6.94 41.15 Favored 'General case' 0 N--CA 1.433 -1.291 0 C-N-CA 124.185 0.994 . . . . 1.0 112.771 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -94.6 -22.53 18.12 Favored 'General case' 0 N--CA 1.434 -1.225 0 O-C-N 120.185 -1.572 . . . . 1.0 111.065 174.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 18.9 pt -110.2 145.03 17.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.088 0 CA-C-O 121.475 0.655 . . . . 1.0 112.368 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -138.17 154.95 49.13 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.403 -1.436 . . . . 1.0 109.176 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -115.41 148.67 39.08 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.502 -1.373 . . . . 1.0 112.803 -169.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.75 151.82 48.52 Favored 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 126.686 1.994 . . . . 1.0 109.133 175.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -130.84 116.19 17.6 Favored 'General case' 0 N--CA 1.433 -1.285 0 N-CA-C 108.797 -0.816 . . . . 1.0 108.797 167.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 37.5 t0 55.08 44.07 28.62 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 125.385 1.474 . . . . 1.0 113.31 178.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.79 2.43 81.36 Favored Glycine 0 N--CA 1.437 -1.288 0 O-C-N 120.314 -1.491 . . . . 1.0 115.924 -177.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -108.93 128.78 24.85 Favored Pre-proline 0 N--CA 1.435 -1.194 0 O-C-N 120.498 -1.59 . . . . 1.0 109.779 -176.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -53.06 135.3 58.73 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 123.469 2.779 . . . . 1.0 116.435 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.3 pt -119.98 141.4 40.35 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 N-CA-C 107.249 -1.389 . . . . 1.0 107.249 174.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.76 160.46 16.71 Favored 'General case' 0 N--CA 1.435 -1.224 0 O-C-N 120.727 -1.233 . . . . 1.0 109.182 -172.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -61.77 -30.07 70.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 119.82 -1.8 . . . . 1.0 114.14 -173.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.1 m -96.58 6.25 49.1 Favored 'General case' 0 N--CA 1.437 -1.078 0 C-N-CA 125.36 1.464 . . . . 1.0 112.489 179.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -71.2 178.84 3.11 Favored 'General case' 0 N--CA 1.434 -1.231 0 O-C-N 118.411 -2.68 . . . . 1.0 113.205 173.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 73.0 p -120.79 151.96 55.32 Favored Pre-proline 0 CA--C 1.498 -1.019 0 O-C-N 120.151 -1.593 . . . . 1.0 113.557 -161.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -56.4 -30.83 83.14 Favored 'Trans proline' 0 N--CA 1.442 -1.5 0 C-N-CA 123.806 3.004 . . . . 1.0 116.637 170.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.56 -45.99 87.97 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 114.141 1.163 . . . . 1.0 114.141 173.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -67.21 -36.76 82.37 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 126.414 1.886 . . . . 1.0 112.793 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.657 HD11 HD12 ' A' ' 84' ' ' ILE . 62.3 tp -81.6 -8.49 59.72 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-O 122.795 1.283 . . . . 1.0 111.399 178.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 56.58 48.26 16.93 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 127.048 2.139 . . . . 1.0 113.376 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 93.7 mtp -62.19 143.48 56.72 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 115.73 1.752 . . . . 1.0 115.73 -178.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -148.57 179.65 7.65 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 106.103 -1.814 . . . . 1.0 106.103 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.284 2.2 p30 -54.86 -26.57 36.38 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 116.655 2.094 . . . . 1.0 116.655 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -135.19 105.19 6.2 Favored 'General case' 0 N--CA 1.436 -1.166 0 C-N-CA 125.446 1.498 . . . . 1.0 108.219 162.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.439 ' HB3' ' HB2' ' A' ' 20' ' ' LEU . 5.0 t0 -100.18 158.73 15.65 Favored 'General case' 0 N--CA 1.436 -1.141 0 O-C-N 120.714 -1.241 . . . . 1.0 112.135 164.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.4 m -136.35 115.29 12.25 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 124.251 1.02 . . . . 1.0 110.57 -176.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.657 HD12 HD11 ' A' ' 76' ' ' LEU . 10.0 mm -120.32 140.81 43.21 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.121 0 C-N-CA 127.962 2.505 . . . . 1.0 109.219 -166.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -110.79 142.27 43.0 Favored 'General case' 0 N--CA 1.437 -1.115 0 O-C-N 119.072 -2.268 . . . . 1.0 108.425 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.7 p -120.38 136.71 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.172 0 C-N-CA 125.114 1.366 . . . . 1.0 109.305 -176.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -133.74 145.13 49.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 C-N-CA 124.438 1.095 . . . . 1.0 108.067 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -105.83 132.59 51.76 Favored 'General case' 0 N--CA 1.433 -1.278 0 O-C-N 120.551 -1.343 . . . . 1.0 113.28 -169.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -114.14 -7.0 13.05 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 124.974 1.31 . . . . 1.0 112.755 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . 0.333 3.8 pt20 59.41 11.98 2.48 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 119.772 3.249 . . . . 1.0 119.772 172.065 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 21.5 m -60.62 129.78 43.26 Favored 'General case' 0 CA--C 1.496 -1.097 0 N-CA-C 116.102 1.89 . . . . 1.0 116.102 -177.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 85.35 -48.47 4.02 Favored Glycine 0 N--CA 1.436 -1.321 0 C-N-CA 125.078 1.323 . . . . 1.0 116.402 156.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.733 0 C-N-CA 125.173 1.368 . . . . 1.0 110.052 -176.32 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.879 0 N-CA-C 113.733 0.253 . . . . 1.0 113.733 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . 0.401 HG21 ' CG2' ' A' ' 30' ' ' VAL 0.333 0.2 OUTLIER -75.83 -54.2 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 N-CA-C 116.143 1.905 . . . . 1.0 116.143 179.562 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -112.37 113.47 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.167 0 O-C-N 121.51 -0.743 . . . . 1.0 109.495 -168.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.04 122.45 44.12 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.662 -1.899 . . . . 1.0 109.667 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 66.8 mt -95.58 153.37 17.75 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 115.748 1.758 . . . . 1.0 115.748 -172.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 32.2 p -111.91 -10.11 14.0 Favored 'General case' 0 CA--C 1.497 -1.062 0 C-N-CA 126.461 1.904 . . . . 1.0 112.885 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 27.7 ttt -80.82 120.28 24.47 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 119.965 -1.709 . . . . 1.0 113.242 -177.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . 0.293 27.0 t0 118.24 90.97 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 131.007 3.723 . . . . 1.0 109.827 175.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 69.15 36.66 2.34 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 127.343 2.257 . . . . 1.0 112.732 178.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 47.88 -153.68 0.08 Allowed 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 126.433 1.893 . . . . 1.0 113.514 -167.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 . . . . . 0 N--CA 1.423 -1.814 0 C-N-CA 126.143 1.777 . . . . 1.0 110.602 171.133 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ptt? . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 114.187 1.18 . . . . 1.0 114.187 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.02 -42.49 80.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 114.969 1.47 . . . . 1.0 114.969 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -119.78 -139.04 0.34 Allowed 'General case' 0 N--CA 1.433 -1.301 0 C-N-CA 124.863 1.265 . . . . 1.0 107.805 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -99.7 -4.79 30.02 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.11 -1.619 . . . . 1.0 113.349 -175.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -93.66 126.04 51.31 Favored Pre-proline 0 N--CA 1.435 -1.187 0 O-C-N 120.729 -1.232 . . . . 1.0 113.055 176.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -53.24 165.78 1.3 Allowed 'Trans proline' 0 N--CA 1.442 -1.513 0 C-N-CA 125.273 3.982 . . . . 1.0 118.698 168.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.9 pttt -132.28 169.68 16.13 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.846 0.832 . . . . 1.0 112.36 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -139.6 157.0 46.54 Favored 'General case' 0 N--CA 1.434 -1.257 0 C-N-CA 125.447 1.499 . . . . 1.0 107.365 172.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -80.54 -7.06 88.94 Favored Glycine 0 N--CA 1.437 -1.259 0 O-C-N 120.422 -1.424 . . . . 1.0 114.589 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.0 m -108.79 7.32 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 C-N-CA 125.832 1.653 . . . . 1.0 111.934 -177.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -132.25 135.01 45.97 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 106.455 -1.683 . . . . 1.0 106.455 173.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.9 t -151.12 152.15 32.97 Favored 'General case' 0 CA--C 1.496 -1.103 0 CA-C-O 122.457 1.122 . . . . 1.0 110.894 -172.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -92.51 -8.39 44.66 Favored 'General case' 0 N--CA 1.434 -1.27 0 C-N-CA 124.94 1.296 . . . . 1.0 111.069 174.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 60.34 39.53 18.65 Favored 'General case' 0 N--CA 1.436 -1.159 0 C-N-CA 128.096 2.559 . . . . 1.0 114.914 -178.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -85.1 142.85 29.23 Favored 'General case' 0 N--CA 1.435 -1.176 0 O-C-N 119.804 -1.81 . . . . 1.0 111.418 177.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -102.28 7.42 40.68 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 122.966 1.365 . . . . 1.0 112.626 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -95.7 133.86 39.29 Favored 'General case' 0 N--CA 1.432 -1.357 0 C-N-CA 125.499 1.52 . . . . 1.0 108.957 152.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.6 pt -138.19 160.72 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 C-N-CA 129.975 3.31 . . . . 1.0 106.198 -171.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -117.89 144.89 45.04 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 119.353 -2.092 . . . . 1.0 110.712 174.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.685 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -134.03 160.83 36.56 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 118.761 -2.462 . . . . 1.0 108.334 173.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -131.7 150.66 52.08 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 119.985 -1.697 . . . . 1.0 112.914 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.477 HG22 ' HB ' ' A' ' 84' ' ' ILE . 47.0 t -119.12 119.28 60.35 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 N-CA-C 107.407 -1.331 . . . . 1.0 107.407 176.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -113.55 130.14 56.42 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.79 0.805 . . . . 1.0 111.918 -170.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -86.95 178.28 48.27 Favored Glycine 0 N--CA 1.433 -1.502 0 CA-C-O 122.948 1.305 . . . . 1.0 115.32 -175.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -85.45 -22.64 28.2 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 124.661 1.185 . . . . 1.0 112.24 -177.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -83.31 -18.14 40.04 Favored 'General case' 0 N--CA 1.433 -1.278 0 O-C-N 120.959 -1.088 . . . . 1.0 111.672 178.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.89 -2.93 6.41 Favored Glycine 0 CA--C 1.492 -1.405 0 O-C-N 120.896 -1.127 . . . . 1.0 114.915 161.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.7 m -109.89 157.73 18.92 Favored 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 119.269 1.535 . . . . 1.0 112.547 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.9 p -139.88 140.98 35.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 C-N-CA 125.528 1.531 . . . . 1.0 110.176 -165.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.72 HG22 HG11 ' B' ' 966' ' ' VAL . 0.9 OUTLIER -119.23 138.74 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.119 0 O-C-N 120.868 -1.145 . . . . 1.0 108.983 174.13 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.435 ' H ' HG21 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -112.68 160.51 17.83 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 126.729 3.157 . . . . 1.0 114.42 179.934 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.437 ' HB2' HD23 ' A' ' 20' ' ' LEU . 8.3 m-85 -145.1 140.64 28.18 Favored 'General case' 0 N--CA 1.428 -1.548 0 O-C-N 118.838 -2.414 . . . . 1.0 107.883 -165.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.277 30.0 ttpt -104.98 115.89 31.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.315 2.246 . . . . 1.0 113.994 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.685 HG21 HD22 ' A' ' 20' ' ' LEU . 6.3 tt -142.67 154.67 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.356 0 CA-C-O 124.007 1.86 . . . . 1.0 110.612 -154.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.438 ' HE3' ' HA ' ' B' ' 973' ' ' ASP 0.266 3.7 mppt? -107.19 165.79 11.11 Favored 'General case' 0 N--CA 1.434 -1.246 0 CA-C-N 113.843 -1.526 . . . . 1.0 113.668 -175.783 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -63.28 -38.05 89.66 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 -160.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -99.14 -4.07 33.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.607 -1.308 . . . . 1.0 112.498 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 m -60.45 134.41 91.34 Favored Pre-proline 0 N--CA 1.437 -1.123 0 C-N-CA 126.294 1.838 . . . . 1.0 113.576 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.73 160.73 37.47 Favored 'Trans proline' 0 N--CA 1.441 -1.6 0 C-N-CA 122.867 2.378 . . . . 1.0 113.712 174.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.375 1.0 OUTLIER -65.58 -25.56 67.46 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 126.101 1.76 . . . . 1.0 114.066 178.613 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.2 p -52.8 -29.02 25.21 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 115.822 1.786 . . . . 1.0 115.822 173.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -65.39 -43.79 89.58 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-N 119.962 1.256 . . . . 1.0 114.079 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.545 HD22 HD21 ' A' ' 20' ' ' LEU . 0.5 OUTLIER -69.69 -31.06 68.88 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.052 -1.655 . . . . 1.0 112.693 177.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 53.3 tpp -60.43 -43.57 96.66 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 120.703 -1.248 . . . . 1.0 113.7 171.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tptt -61.57 -43.35 99.03 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.696 -1.252 . . . . 1.0 113.381 171.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.38 -34.04 73.94 Favored 'General case' 0 N--CA 1.436 -1.16 0 O-C-N 119.739 -1.85 . . . . 1.0 114.147 178.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.4 -36.88 79.15 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 127.217 2.207 . . . . 1.0 111.56 170.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 53' ' ' LEU . 77.7 m -69.9 -30.76 68.26 Favored 'General case' 0 N--CA 1.432 -1.344 0 C-N-CA 127.454 2.302 . . . . 1.0 113.671 170.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -67.07 -52.65 39.45 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 119.12 -2.237 . . . . 1.0 113.386 165.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 46.4 mtt180 -78.92 -43.44 24.75 Favored 'General case' 0 N--CA 1.437 -1.117 1 N-CA-C 125.339 5.311 . . . . 1.0 125.339 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.5 mm-40 -160.98 -18.03 0.05 Allowed 'General case' 0 CA--C 1.501 -0.938 0 N-CA-C 119.955 3.317 . . . . 1.0 119.955 -157.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -98.27 -37.56 4.29 Favored Glycine 0 CA--C 1.492 -1.375 0 O-C-N 118.55 -2.594 . . . . 1.0 110.83 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.461 ' HA ' ' HA ' ' A' ' 48' ' ' CYS 0.884 0.1 OUTLIER 57.16 -28.49 0.02 OUTLIER 'General case' 0 CA--C 1.489 -1.397 2 N-CA-C 128.003 6.297 . . . . 1.0 128.003 161.769 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 34.8 m -102.4 123.65 46.55 Favored 'General case' 0 N--CA 1.427 -1.617 0 N-CA-C 105.94 -1.874 . . . . 1.0 105.94 154.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -63.76 -18.52 64.15 Favored 'General case' 0 N--CA 1.435 -1.221 0 O-C-N 120.689 -1.257 . . . . 1.0 112.564 169.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -90.86 -3.52 57.3 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 113.307 0.855 . . . . 1.0 113.307 174.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -82.07 -38.54 24.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 120.009 -1.682 . . . . 1.0 112.527 172.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.6 pp -128.03 141.95 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.125 0 O-C-N 121.295 -0.878 . . . . 1.0 112.959 -165.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -138.27 155.06 48.98 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.549 1.539 . . . . 1.0 108.738 174.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -106.13 144.96 32.1 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.677 -1.264 . . . . 1.0 112.578 -168.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -126.39 145.18 50.56 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 126.284 1.834 . . . . 1.0 112.771 177.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -116.38 111.74 20.48 Favored 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.657 1.183 . . . . 1.0 108.549 168.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.6 t70 48.06 50.39 16.06 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 126.72 2.008 . . . . 1.0 114.574 176.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.73 0.89 89.9 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 117.544 1.778 . . . . 1.0 117.544 -178.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -118.3 133.46 23.49 Favored Pre-proline 0 N--CA 1.435 -1.206 0 CA-C-N 120.549 2.175 . . . . 1.0 110.528 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_exo -48.0 135.22 23.87 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 124.424 3.416 . . . . 1.0 117.55 168.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 13.6 pt -116.58 154.97 18.13 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 C-N-CA 124.826 1.251 . . . . 1.0 107.849 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -103.33 160.49 14.64 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.927 -1.108 . . . . 1.0 110.096 -175.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -63.18 -28.2 69.89 Favored 'General case' 0 CA--C 1.496 -1.106 0 O-C-N 119.554 -1.966 . . . . 1.0 114.04 174.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.3 m -92.29 -0.26 57.41 Favored 'General case' 0 N--CA 1.437 -1.091 0 O-C-N 120.98 -1.075 . . . . 1.0 112.022 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -67.84 174.59 3.55 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.489 -2.007 . . . . 1.0 113.54 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.6 p -111.01 150.52 42.03 Favored Pre-proline 0 N--CA 1.438 -1.069 0 O-C-N 120.275 -1.515 . . . . 1.0 112.32 -156.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -58.01 -32.98 96.66 Favored 'Trans proline' 0 N--CA 1.44 -1.62 0 C-N-CA 122.959 2.439 . . . . 1.0 115.585 170.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.79 -45.37 82.65 Favored 'General case' 0 N--CA 1.434 -1.251 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 177.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -66.66 -34.36 77.69 Favored 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.755 1.622 . . . . 1.0 113.595 -177.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 42.3 tp -95.33 -5.15 44.12 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.951 1.701 . . . . 1.0 112.023 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 59.47 45.33 13.71 Favored 'General case' 0 N--CA 1.436 -1.131 0 C-N-CA 127.468 2.307 . . . . 1.0 114.817 175.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.0 mtp -65.76 135.96 55.6 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 116.503 2.038 . . . . 1.0 116.503 -177.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -150.48 -173.77 4.56 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.66 1.584 . . . . 1.0 108.516 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -55.77 -26.72 47.25 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 118.157 2.651 . . . . 1.0 118.157 -172.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -141.49 83.15 1.85 Allowed 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.747 1.219 . . . . 1.0 108.311 167.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -85.59 159.6 19.83 Favored 'General case' 0 CA--C 1.498 -1.058 0 O-C-N 120.667 -1.271 . . . . 1.0 112.538 175.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -127.59 128.2 45.16 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 124.481 1.112 . . . . 1.0 109.843 174.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.477 ' HB ' HG22 ' A' ' 22' ' ' VAL . 77.1 mt -118.31 140.78 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 129.256 3.022 . . . . 1.0 106.605 178.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -110.75 145.51 37.96 Favored 'General case' 0 N--CA 1.436 -1.175 0 O-C-N 119.526 -1.984 . . . . 1.0 105.893 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -108.56 139.73 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.302 0 O-C-N 120.721 -1.237 . . . . 1.0 108.215 -171.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -119.3 135.26 54.79 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-O 123.054 1.407 . . . . 1.0 108.673 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 62.4 tp60 -81.99 120.58 25.43 Favored 'General case' 0 N--CA 1.432 -1.336 0 C-N-CA 125.344 1.458 . . . . 1.0 110.148 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -89.88 -152.69 0.26 Allowed 'General case' 0 N--CA 1.433 -1.311 0 O-C-N 121.295 -0.878 . . . . 1.0 110.847 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 57.97 44.86 19.01 Favored 'General case' 0 N--CA 1.437 -1.079 0 C-N-CA 125.14 1.376 . . . . 1.0 114.024 -175.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 42.3 p -62.85 147.04 51.29 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 115.117 1.525 . . . . 1.0 115.117 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -94.36 -148.44 23.97 Favored Glycine 0 N--CA 1.436 -1.349 0 C-N-CA 124.801 1.191 . . . . 1.0 112.904 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.714 0 O-C-N 121.018 -1.284 . . . . 1.0 111.165 179.241 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.999 0 N-CA-C 112.567 -0.213 . . . . 1.0 112.567 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . 0.72 HG11 HG22 ' A' ' 30' ' ' VAL . 28.4 t -89.36 -102.63 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.202 0 O-C-N 121.078 -1.248 . . . . 1.0 111.943 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . 0.415 ' N ' HG12 ' B' ' 966' ' ' VAL . 0.4 OUTLIER -95.44 132.04 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 O-C-N 120.803 -1.185 . . . . 1.0 111.892 -157.092 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -102.0 107.95 19.24 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 125.509 1.524 . . . . 1.0 108.397 173.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.589 HD11 ' HB ' ' A' ' 34' ' ' ILE . 0.5 OUTLIER -108.01 151.33 25.97 Favored 'General case' 0 CA--C 1.494 -1.2 0 O-C-N 119.741 -1.849 . . . . 1.0 114.85 -176.814 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 44.9 p -84.61 174.18 10.18 Favored 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 127.513 2.325 . . . . 1.0 111.782 177.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.256 24.3 ttt 89.67 123.29 0.03 OUTLIER 'General case' 0 CA--C 1.496 -1.11 0 C-N-CA 127.891 2.476 . . . . 1.0 111.138 175.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 15.4 t0 66.88 48.42 1.32 Allowed 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 126.077 1.751 . . . . 1.0 111.787 -164.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . 0.438 ' HA ' ' HE3' ' A' ' 35' ' ' LYS . 32.5 m-20 -78.06 83.18 4.36 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 117.45 2.389 . . . . 1.0 117.45 -163.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -65.62 -50.18 65.99 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.689 -1.257 . . . . 1.0 111.375 152.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 . . . . . 0 N--CA 1.427 -1.602 0 C-N-CA 127.194 2.197 . . . . 1.0 112.206 176.487 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.1 mmt . . . . . 0 N--CA 1.481 1.113 0 CA-C-O 119.803 -0.142 . . . . 1.0 111.366 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.3 -36.36 81.35 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 119.9 -1.75 . . . . 1.0 114.021 169.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -62.96 -46.84 85.84 Favored 'General case' 0 N--CA 1.434 -1.255 0 C-N-CA 127.061 2.144 . . . . 1.0 114.817 177.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -155.94 145.63 21.11 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.488 -1.671 . . . . 1.0 106.488 175.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -65.94 147.0 99.0 Favored Pre-proline 0 N--CA 1.437 -1.08 0 O-C-N 120.07 -1.644 . . . . 1.0 114.764 -176.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -75.07 145.98 31.86 Favored 'Trans proline' 0 N--CA 1.44 -1.647 0 C-N-CA 122.614 2.209 . . . . 1.0 112.195 173.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -137.16 168.01 20.44 Favored 'General case' 0 N--CA 1.436 -1.153 0 C-N-CA 124.605 1.162 . . . . 1.0 110.237 -177.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -59.64 146.51 40.81 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 120.605 -1.309 . . . . 1.0 114.331 -178.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -78.58 -2.13 84.32 Favored Glycine 0 N--CA 1.436 -1.328 0 N-CA-C 117.313 1.685 . . . . 1.0 117.313 -169.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.1 p -57.02 139.77 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.144 0 C-N-CA 126.682 1.993 . . . . 1.0 115.313 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -117.4 128.69 55.27 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.211 -1.556 . . . . 1.0 109.757 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.5 p -105.67 -1.14 24.91 Favored 'General case' 0 CA--C 1.495 -1.163 0 O-C-N 120.169 -1.582 . . . . 1.0 112.85 -177.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -60.3 154.13 20.87 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 125.703 1.601 . . . . 1.0 114.435 171.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -62.89 149.67 43.9 Favored 'General case' 0 N--CA 1.436 -1.161 0 O-C-N 120.658 -1.276 . . . . 1.0 112.693 171.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 4.8 p-10 -92.72 12.78 22.23 Favored 'General case' 0 N--CA 1.436 -1.151 0 O-C-N 120.213 -1.554 . . . . 1.0 114.66 -165.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.5 p-10 -87.33 -15.1 38.93 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 116.349 1.981 . . . . 1.0 116.349 -172.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 34.0 p-80 -121.33 161.91 21.23 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 117.475 2.398 . . . . 1.0 117.475 -171.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -132.68 160.73 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 C-N-CA 130.98 3.712 . . . . 1.0 105.096 173.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -112.25 144.77 41.1 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.285 -2.135 . . . . 1.0 109.757 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -137.43 160.44 39.1 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.263 -2.148 . . . . 1.0 105.854 177.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -138.05 150.68 47.14 Favored 'General case' 0 N--CA 1.434 -1.238 0 O-C-N 119.556 -1.965 . . . . 1.0 111.416 178.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.429 HG22 ' CE1' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -108.77 132.82 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.612 0 C-N-CA 125.781 1.632 . . . . 1.0 108.21 174.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.36 130.15 56.33 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 123.976 0.91 . . . . 1.0 109.419 173.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -90.12 -176.51 45.0 Favored Glycine 0 N--CA 1.435 -1.391 0 CA-C-O 122.566 1.092 . . . . 1.0 114.992 -176.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -61.55 -33.63 74.17 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 126.383 1.873 . . . . 1.0 112.869 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -90.83 0.56 57.43 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 120.704 -1.248 . . . . 1.0 112.771 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.92 4.15 90.38 Favored Glycine 0 N--CA 1.436 -1.333 0 O-C-N 120.51 -1.369 . . . . 1.0 115.535 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.5 m -70.32 140.71 52.31 Favored 'General case' 0 CA--C 1.495 -1.158 0 O-C-N 120.593 -1.534 . . . . 1.0 110.872 171.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.4 p -134.01 133.5 56.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 O-C-N 121.326 -0.859 . . . . 1.0 112.231 -169.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.658 HG22 HG11 ' B' ' 966' ' ' VAL 0.26 0.7 OUTLIER -129.24 138.78 53.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 O-C-N 120.056 -1.653 . . . . 1.0 111.616 166.897 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.1 161.6 14.61 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 126.629 3.109 . . . . 1.0 115.686 173.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.429 ' CE1' HG22 ' A' ' 22' ' ' VAL . 3.6 m-85 -145.11 157.65 44.04 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.255 -2.778 . . . . 1.0 107.139 -173.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.268 24.1 ttpt -120.52 115.85 24.25 Favored 'General case' 0 N--CA 1.434 -1.238 0 C-N-CA 124.813 1.245 . . . . 1.0 109.686 -176.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 18.6 tt -148.56 154.74 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.466 0 CA-C-O 125.121 2.391 . . . . 1.0 112.028 -162.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.49 163.29 14.69 Favored 'General case' 0 N--CA 1.432 -1.335 0 CA-C-N 111.476 -2.602 . . . . 1.0 111.741 -177.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 71.0 mtt85 -71.29 -37.97 71.82 Favored 'General case' 0 N--CA 1.435 -1.184 0 N-CA-C 116.441 2.015 . . . . 1.0 116.441 -164.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -98.73 -11.51 21.85 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 120.581 -1.325 . . . . 1.0 112.33 -175.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.4 m -59.66 137.1 89.82 Favored Pre-proline 0 N--CA 1.435 -1.192 0 C-N-CA 126.291 1.836 . . . . 1.0 112.73 170.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -71.36 155.25 60.51 Favored 'Trans proline' 0 N--CA 1.44 -1.658 0 CA-C-N 123.642 2.336 . . . . 1.0 114.994 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.399 2.0 pp -62.01 -25.57 67.73 Favored 'General case' 0 N--CA 1.434 -1.273 0 C-N-CA 125.539 1.535 . . . . 1.0 114.67 174.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.0 p -52.64 -29.11 24.46 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.281 -2.137 . . . . 1.0 114.86 170.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.82 -41.73 87.01 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 119.97 -1.707 . . . . 1.0 112.605 -174.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.35 -37.28 84.96 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.78 -1.2 . . . . 1.0 113.85 170.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.0 ttm -60.2 -42.55 95.35 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 120.243 -1.536 . . . . 1.0 113.771 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.96 -43.62 98.47 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.539 -1.351 . . . . 1.0 112.497 172.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.73 -35.12 79.37 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 114.753 1.39 . . . . 1.0 114.753 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -58.55 -43.81 89.43 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 127.355 2.262 . . . . 1.0 111.767 174.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 99.8 m -62.25 -42.36 99.26 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 124.907 1.283 . . . . 1.0 113.531 173.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.09 -46.99 72.59 Favored 'General case' 0 N--CA 1.435 -1.217 0 N-CA-C 115.054 1.501 . . . . 1.0 115.054 176.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.465 ' HB2' HD11 ' B' ' 967' ' ' ILE . 2.8 mtt180 -75.6 -43.2 49.34 Favored 'General case' 0 CA--C 1.495 -1.136 0 O-C-N 120.276 -1.515 . . . . 1.0 114.722 178.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -114.98 8.93 15.94 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 113.12 0.785 . . . . 1.0 113.12 -162.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.14 9.47 86.07 Favored Glycine 0 N--CA 1.437 -1.285 0 N-CA-C 117.355 1.702 . . . . 1.0 117.355 161.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.2 mt -85.82 162.77 18.5 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 121.321 -1.105 . . . . 1.0 113.446 -174.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.9 m -102.32 129.41 48.75 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 124.307 1.043 . . . . 1.0 110.307 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -66.54 -22.52 66.16 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 116.47 2.026 . . . . 1.0 116.47 -171.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -90.47 -1.59 57.9 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.317 -1.489 . . . . 1.0 112.759 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -100.49 -10.37 21.16 Favored 'General case' 0 N--CA 1.435 -1.223 0 O-C-N 120.775 -1.203 . . . . 1.0 111.644 177.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -122.92 146.58 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 O-C-N 120.581 -1.324 . . . . 1.0 110.03 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -138.24 154.97 49.06 Favored 'General case' 0 N--CA 1.436 -1.171 0 N-CA-C 107.698 -1.223 . . . . 1.0 107.698 171.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -113.97 148.61 36.6 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.655 1.217 . . . . 1.0 110.74 -173.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -137.41 156.89 47.66 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.642 -1.286 . . . . 1.0 108.429 173.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -131.85 113.87 14.0 Favored 'General case' 0 N--CA 1.433 -1.289 0 O-C-N 120.987 -1.071 . . . . 1.0 108.522 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 27.0 t0 53.5 46.52 26.0 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 125.534 1.534 . . . . 1.0 113.473 -177.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.65 5.78 86.42 Favored Glycine 0 N--CA 1.436 -1.32 0 O-C-N 120.209 -1.557 . . . . 1.0 116.838 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -119.12 133.14 23.73 Favored Pre-proline 0 N--CA 1.436 -1.136 0 CA-C-N 119.589 1.695 . . . . 1.0 110.137 -177.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -73.43 142.24 32.89 Favored 'Trans proline' 0 C--N 1.308 -1.583 0 CA-C-N 124.173 2.526 . . . . 1.0 113.147 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.0 pt -120.13 145.43 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 C-N-CA 124.931 1.292 . . . . 1.0 109.968 -175.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -109.8 162.89 14.03 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.568 -1.332 . . . . 1.0 111.001 -165.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -70.87 -13.93 62.21 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 119.738 -1.851 . . . . 1.0 112.796 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -83.07 -14.88 52.89 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 126.874 2.07 . . . . 1.0 112.656 169.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.87 172.24 11.56 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.744 -1.848 . . . . 1.0 111.634 178.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 82.7 p -147.18 157.25 46.2 Favored Pre-proline 0 CA--C 1.496 -1.097 0 O-C-N 119.962 -1.711 . . . . 1.0 110.202 -162.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -59.85 -32.53 95.49 Favored 'Trans proline' 0 N--CA 1.439 -1.685 0 C-N-CA 123.259 2.639 . . . . 1.0 115.17 170.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.59 -46.05 84.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 113.477 0.918 . . . . 1.0 113.477 175.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -68.22 -39.08 82.46 Favored 'General case' 0 N--CA 1.433 -1.279 0 C-N-CA 126.026 1.73 . . . . 1.0 113.355 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 17.4 tp -85.03 -8.47 58.69 Favored 'General case' 0 N--CA 1.434 -1.237 0 CA-C-O 121.809 0.814 . . . . 1.0 113.128 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 64.41 42.47 5.13 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 128.421 2.688 . . . . 1.0 114.996 174.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 73.9 mtm -73.73 154.37 39.64 Favored 'General case' 0 N--CA 1.432 -1.328 0 C-N-CA 127.836 2.454 . . . . 1.0 114.29 176.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -126.76 -175.32 3.37 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 107.488 -1.301 . . . . 1.0 107.488 -168.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.315 8.6 p-10 -56.51 -26.48 54.72 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 117.014 2.227 . . . . 1.0 117.014 -172.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -137.64 92.46 2.69 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 118.503 0.592 . . . . 1.0 111.682 162.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.72 164.8 11.69 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.833 -1.792 . . . . 1.0 115.119 174.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -126.65 120.08 28.61 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 122.52 1.153 . . . . 1.0 112.52 -173.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 mt -105.7 140.73 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 C-N-CA 128.772 2.829 . . . . 1.0 109.078 178.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -110.92 136.08 50.47 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 120.305 -1.497 . . . . 1.0 107.97 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 36.5 t -115.17 138.93 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 O-C-N 120.96 -1.088 . . . . 1.0 109.546 -171.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -128.03 140.13 52.14 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-O 122.101 0.953 . . . . 1.0 110.391 172.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -90.24 126.69 35.92 Favored 'General case' 0 N--CA 1.434 -1.227 0 C-N-CA 124.269 1.028 . . . . 1.0 111.471 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -86.71 175.3 8.33 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 116.178 1.918 . . . . 1.0 116.178 -167.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 12.5 tp-100 -137.66 128.19 26.64 Favored 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 123.594 0.758 . . . . 1.0 110.863 -178.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.2 t -153.78 150.78 28.84 Favored 'General case' 0 CA--C 1.496 -1.105 0 O-C-N 120.486 -1.384 . . . . 1.0 110.13 174.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -80.51 -4.36 90.1 Favored Glycine 0 N--CA 1.436 -1.329 0 O-C-N 120.536 -1.352 . . . . 1.0 114.69 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.678 0 O-C-N 121.067 -1.255 . . . . 1.0 111.211 175.965 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.84 0 N-CA-C 114.889 0.716 . . . . 1.0 114.889 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . 0.658 HG11 HG22 ' A' ' 30' ' ' VAL . 34.2 t -90.48 -108.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 124.579 1.152 . . . . 1.0 109.959 174.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . 0.465 HD11 ' HB2' ' A' ' 50' ' ' ARG . 0.9 OUTLIER -90.83 130.61 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 O-C-N 120.881 -1.137 . . . . 1.0 111.37 -155.068 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -102.07 121.9 43.08 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.177 -1.577 . . . . 1.0 111.663 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.03 140.57 40.99 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.734 -1.228 . . . . 1.0 112.704 177.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 41.4 p -127.95 -25.67 3.02 Favored 'General case' 0 N--CA 1.436 -1.142 0 C-N-CA 124.286 1.034 . . . . 1.0 112.045 174.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.327 12.9 ttt 17.0 -109.61 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.031 0 C-N-CA 129.941 3.296 . . . . 1.0 119.199 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -147.64 -172.25 3.99 Favored 'General case' 0 N--CA 1.433 -1.323 0 N-CA-C 106.875 -1.528 . . . . 1.0 106.875 -172.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 69.07 16.07 8.69 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 117.652 2.464 . . . . 1.0 117.652 171.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 40.45 -125.09 0.45 Allowed 'General case' 0 N--CA 1.437 -1.121 0 C-N-CA 125.758 1.623 . . . . 1.0 113.692 -167.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . 0.403 ' H ' ' HG3' ' B' ' 975' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.426 -1.664 0 C-N-CA 127.549 2.34 . . . . 1.0 116.662 175.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.3 ptt? . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 114.294 1.22 . . . . 1.0 114.294 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.26 91.52 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 115.113 1.523 . . . . 1.0 115.113 -174.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -61.17 -28.74 69.35 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 115.253 1.575 . . . . 1.0 115.253 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.51 -39.17 91.52 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 124.721 1.208 . . . . 1.0 113.775 173.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -67.55 144.17 97.54 Favored Pre-proline 0 N--CA 1.435 -1.222 0 N-CA-C 114.997 1.48 . . . . 1.0 114.997 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.11 146.84 4.09 Favored 'Trans proline' 0 N--CA 1.443 -1.461 0 C-N-CA 125.121 3.881 . . . . 1.0 117.851 169.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -84.03 -15.01 49.15 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.904 -1.123 . . . . 1.0 113.828 -169.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -113.43 11.92 18.59 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 125.339 1.456 . . . . 1.0 111.386 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 77.37 169.99 33.31 Favored Glycine 0 N--CA 1.436 -1.327 0 O-C-N 120.503 -1.373 . . . . 1.0 116.522 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.6 p -126.36 130.56 71.92 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 124.666 1.186 . . . . 1.0 110.892 -172.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt 59.12 37.84 23.99 Favored 'General case' 0 N--CA 1.435 -1.182 0 C-N-CA 126.852 2.061 . . . . 1.0 114.198 -176.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 45.2 p -115.79 23.76 12.04 Favored 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 125.634 1.573 . . . . 1.0 110.378 178.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -91.22 -4.53 55.92 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 120.372 -1.455 . . . . 1.0 112.561 -169.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.0 m120 55.79 -169.57 0.08 Allowed 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 127.904 2.482 . . . . 1.0 114.888 -175.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -120.72 14.16 11.69 Favored 'General case' 0 N--CA 1.435 -1.191 0 O-C-N 120.099 -1.626 . . . . 1.0 114.383 -166.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -90.04 96.11 10.52 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 119.936 -1.728 . . . . 1.0 111.55 -169.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -73.92 135.27 43.26 Favored 'General case' 0 N--CA 1.435 -1.189 0 N-CA-C 115.123 1.527 . . . . 1.0 115.123 -179.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.404 ' HB ' ' HA ' ' A' ' 80' ' ' ASP . 19.9 pt -134.54 160.7 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 C-N-CA 129.489 3.115 . . . . 1.0 105.045 174.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -117.8 144.74 45.08 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 119.286 -2.134 . . . . 1.0 109.717 175.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.97 157.51 43.89 Favored 'General case' 0 CA--C 1.494 -1.203 0 O-C-N 119.531 -1.98 . . . . 1.0 108.495 166.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -119.02 150.62 39.65 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-O 122.795 1.283 . . . . 1.0 113.274 172.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.32 133.08 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.288 0 N-CA-C 107.567 -1.272 . . . . 1.0 107.567 173.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -142.82 140.57 31.36 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-O 122.796 1.284 . . . . 1.0 114.371 -163.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 150.89 -152.63 24.42 Favored Glycine 0 CA--C 1.493 -1.32 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.739 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.411 HE22 ' HB3' ' A' ' 88' ' ' GLN . 67.2 mm-40 53.77 48.3 21.73 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 116.57 2.063 . . . . 1.0 116.57 171.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 52.2 m-20 70.68 38.61 1.23 Allowed 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 127.951 2.501 . . . . 1.0 111.715 178.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.03 26.59 25.93 Favored Glycine 0 N--CA 1.435 -1.42 0 O-C-N 121.194 -0.941 . . . . 1.0 113.95 173.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.0 m -90.59 127.79 36.38 Favored 'General case' 0 CA--C 1.495 -1.148 0 O-C-N 120.912 -1.346 . . . . 1.0 109.721 165.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 47.4 t -139.91 133.09 35.57 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.228 0 N-CA-C 107.82 -1.178 . . . . 1.0 107.82 -178.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.416 HG22 ' CD1' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -129.14 135.02 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 119.681 -1.887 . . . . 1.0 108.535 161.478 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.71 145.04 26.16 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-O 123.298 1.523 . . . . 1.0 112.785 159.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.66 ' CE2' HD21 ' B' ' 969' ' ' LEU . 0.0 OUTLIER -138.92 140.61 38.39 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.946 -1.096 . . . . 1.0 108.747 -164.634 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.681 ' O ' HD23 ' B' ' 969' ' ' LEU 0.431 31.3 ttpt -113.48 115.29 27.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.896 1.808 . . . . 1.0 111.798 -169.579 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.8 tp -142.68 154.86 17.83 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.484 0 CA-C-N 110.935 -2.848 . . . . 1.0 111.799 -153.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . 0.254 9.2 mtpt -86.68 154.7 20.79 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 112.098 -2.319 . . . . 1.0 112.676 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -71.06 -18.05 62.58 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 117.756 2.502 . . . . 1.0 117.756 -151.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -99.65 -49.93 4.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 119.799 -1.813 . . . . 1.0 111.719 171.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.6 m -34.0 132.24 0.39 Allowed Pre-proline 0 N--CA 1.439 -1.023 0 C-N-CA 131.286 3.834 . . . . 1.0 118.819 -176.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -45.34 152.41 0.77 Allowed 'Trans proline' 0 N--CA 1.443 -1.456 2 N-CA-C 125.464 5.14 . . . . 1.0 125.464 -165.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -71.18 -25.77 62.68 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 113.695 0.998 . . . . 1.0 113.695 157.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . 0.273 80.9 p -57.67 -29.07 64.32 Favored 'General case' 0 N--CA 1.437 -1.124 0 O-C-N 119.73 -1.856 . . . . 1.0 114.089 175.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -62.16 -42.56 99.38 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 124.765 1.226 . . . . 1.0 111.075 174.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -42.9 82.82 Favored 'General case' 0 CA--C 1.491 -1.315 0 C-N-CA 127.639 2.376 . . . . 1.0 112.459 176.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.7 ttt -56.84 -43.07 80.75 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 114.156 1.169 . . . . 1.0 114.156 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -65.74 -41.81 91.71 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.897 -1.127 . . . . 1.0 113.274 172.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.8 -38.71 91.76 Favored 'General case' 0 N--CA 1.435 -1.188 0 C-N-CA 124.68 1.192 . . . . 1.0 113.922 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.416 ' CD1' HG22 ' A' ' 30' ' ' VAL . 3.2 t80 -60.22 -43.2 96.2 Favored 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 126.802 2.041 . . . . 1.0 112.036 171.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.5 m -64.41 -43.05 95.62 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.355 -1.465 . . . . 1.0 114.182 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -65.08 -48.2 74.55 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.468 -1.395 . . . . 1.0 114.283 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -75.33 -43.22 51.86 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 115.505 1.669 . . . . 1.0 115.505 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -114.53 8.36 16.4 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 121.084 -1.01 . . . . 1.0 112.049 -163.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.88 3.43 90.53 Favored Glycine 0 CA--C 1.493 -1.288 0 N-CA-C 117.439 1.735 . . . . 1.0 117.439 159.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.55 155.27 40.23 Favored 'General case' 0 N--CA 1.434 -1.236 0 C-N-CA 125.741 1.616 . . . . 1.0 113.386 -174.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.9 m -102.19 124.93 48.64 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 120.378 -1.451 . . . . 1.0 109.144 175.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.2 ptm -60.95 -29.15 69.47 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 117.019 2.229 . . . . 1.0 117.019 -170.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -75.99 -15.54 60.13 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 120.16 -1.588 . . . . 1.0 114.218 176.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.8 mt-30 -97.32 -9.61 27.21 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 125.564 1.546 . . . . 1.0 112.287 -175.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.0 pt -120.88 143.99 31.27 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 C-N-CA 124.248 1.019 . . . . 1.0 109.597 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -135.92 154.92 50.97 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -113.93 148.54 36.66 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 120.484 -1.385 . . . . 1.0 109.745 -172.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -137.66 159.41 42.06 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-O 123.116 1.436 . . . . 1.0 111.927 177.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -133.25 117.42 17.36 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.177 -1.828 . . . . 1.0 107.992 170.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.7 t70 59.29 31.66 21.34 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 127.312 2.245 . . . . 1.0 113.238 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.48 2.7 88.17 Favored Glycine 0 N--CA 1.435 -1.393 0 O-C-N 119.955 -1.716 . . . . 1.0 114.646 -176.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -102.12 137.06 19.37 Favored Pre-proline 0 N--CA 1.435 -1.214 0 O-C-N 120.161 -1.788 . . . . 1.0 110.076 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -49.09 135.28 30.23 Favored 'Trans proline' 0 N--CA 1.442 -1.553 0 C-N-CA 124.547 3.498 . . . . 1.0 117.832 170.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 21.6 pt -121.89 142.49 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 108.244 -1.021 . . . . 1.0 108.244 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -97.65 167.61 10.86 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 121.143 -0.973 . . . . 1.0 110.922 -175.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -67.63 -19.92 65.28 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.444 -1.41 . . . . 1.0 112.684 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.6 m -99.43 2.0 44.69 Favored 'General case' 0 N--CA 1.436 -1.175 0 C-N-CA 126.764 2.026 . . . . 1.0 111.687 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -80.6 169.07 18.13 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 119.028 -2.295 . . . . 1.0 112.24 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.0 p -106.7 153.04 40.94 Favored Pre-proline 0 N--CA 1.438 -1.027 0 O-C-N 120.905 -1.122 . . . . 1.0 113.481 -157.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -58.05 -31.35 92.82 Favored 'Trans proline' 0 N--CA 1.44 -1.625 0 C-N-CA 123.374 2.716 . . . . 1.0 116.582 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.35 -45.83 78.84 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 114.029 1.122 . . . . 1.0 114.029 174.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.02 -41.3 82.36 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 125.661 1.584 . . . . 1.0 112.622 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 27.7 tp -87.19 -4.03 59.09 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 124.269 1.027 . . . . 1.0 111.601 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 56.85 44.42 23.29 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 126.554 1.942 . . . . 1.0 113.396 176.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 91.0 mtp -65.98 143.29 57.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.98 2.112 . . . . 1.0 115.148 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -157.56 179.58 9.1 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 105.837 -1.912 . . . . 1.0 105.837 -171.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.404 ' HA ' ' HB ' ' A' ' 18' ' ' ILE 0.3 6.7 p-10 -51.3 -26.52 7.58 Favored 'General case' 0 N--CA 1.436 -1.156 0 C-N-CA 128.511 2.724 . . . . 1.0 118.239 -178.279 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -137.78 67.45 1.42 Allowed 'General case' 0 N--CA 1.436 -1.152 0 C-N-CA 125.106 1.362 . . . . 1.0 110.638 173.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -78.38 162.68 26.26 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 119.342 -2.098 . . . . 1.0 114.409 179.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.6 m -135.39 123.64 23.12 Favored 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.36 1.064 . . . . 1.0 111.053 178.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 78.8 mt -108.0 140.54 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 C-N-CA 126.371 1.869 . . . . 1.0 108.841 174.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -110.97 140.12 45.74 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.612 -1.305 . . . . 1.0 108.562 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.6 t -108.53 139.07 32.38 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.201 0 O-C-N 120.559 -1.338 . . . . 1.0 109.959 -169.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -124.67 142.63 51.25 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 122.468 1.127 . . . . 1.0 110.059 173.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.411 ' HB3' HE22 ' A' ' 25' ' ' GLN . 6.7 pm0 -81.84 140.22 34.27 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 125.065 1.346 . . . . 1.0 111.851 -178.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -138.24 141.96 39.92 Favored 'General case' 0 N--CA 1.434 -1.251 0 O-C-N 120.618 -1.301 . . . . 1.0 109.971 -172.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -107.28 159.33 16.44 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 121.127 -0.983 . . . . 1.0 110.741 -178.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 14.7 t -153.41 153.02 31.72 Favored 'General case' 0 N--CA 1.437 -1.097 0 O-C-N 120.905 -1.122 . . . . 1.0 109.059 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -74.17 -171.95 26.12 Favored Glycine 0 CA--C 1.494 -1.241 0 N-CA-C 116.904 1.522 . . . . 1.0 116.904 -171.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.777 0 O-C-N 121.359 -1.083 . . . . 1.0 111.833 178.833 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.932 0 N-CA-C 115.148 0.819 . . . . 1.0 115.148 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 2.1 p -74.82 -39.96 46.07 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.172 0 CA-C-O 122.801 1.286 . . . . 1.0 111.301 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 3.6 mt -113.13 120.32 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 C-N-CA 125.092 1.357 . . . . 1.0 109.719 162.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.0 140.29 36.49 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 105.032 -2.21 . . . . 1.0 105.032 164.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 33' ' ' LYS . 4.0 mm? -73.85 137.89 44.05 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 122.668 2.485 . . . . 1.0 116.754 -175.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 20.9 p -120.86 8.85 10.56 Favored 'General case' 0 CA--C 1.497 -1.095 0 C-N-CA 126.239 1.816 . . . . 1.0 112.073 -171.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 34.5 mtm -115.91 13.3 15.98 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.617 -1.302 . . . . 1.0 111.558 -173.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -147.66 -25.93 0.37 Allowed 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 115.63 1.715 . . . . 1.0 115.63 -153.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 53.6 -175.7 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 123.69 1.71 . . . . 1.0 114.714 -159.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -60.51 -43.96 96.52 Favored 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 127.433 2.293 . . . . 1.0 113.271 178.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 . . . . . 0 N--CA 1.424 -1.748 0 C-N-CA 130.795 3.638 . . . . 1.0 111.292 175.59 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.8 mtt . . . . . 0 N--CA 1.484 1.261 0 N-CA-C 109.773 -0.454 . . . . 1.0 109.773 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -90.35 -5.98 55.57 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 119.793 -1.817 . . . . 1.0 112.929 173.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -64.98 -46.15 82.66 Favored 'General case' 0 N--CA 1.433 -1.303 0 C-N-CA 126.228 1.811 . . . . 1.0 113.995 177.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -63.74 150.1 45.28 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 128.331 2.652 . . . . 1.0 117.016 -175.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -65.59 150.22 96.34 Favored Pre-proline 0 N--CA 1.433 -1.284 0 C-N-CA 125.827 1.651 . . . . 1.0 112.522 168.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -46.85 139.4 14.29 Favored 'Trans proline' 0 C--N 1.308 -1.592 0 C-N-CA 124.397 3.398 . . . . 1.0 116.457 158.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -129.85 -9.5 4.43 Favored 'General case' 0 N--CA 1.436 -1.136 0 C-N-CA 124.267 1.027 . . . . 1.0 112.541 -174.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.7 tp10 -86.94 147.32 25.81 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 125.133 1.373 . . . . 1.0 111.839 176.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -75.33 -166.05 17.74 Favored Glycine 0 N--CA 1.437 -1.28 0 O-C-N 120.603 -1.311 . . . . 1.0 116.119 173.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.312 2.5 t 62.17 62.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.063 0 C-N-CA 126.252 1.821 . . . . 1.0 115.912 172.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -66.31 151.84 46.23 Favored 'General case' 0 N--CA 1.436 -1.167 0 O-C-N 120.508 -1.37 . . . . 1.0 114.336 173.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 57.7 p -75.91 -11.04 59.89 Favored 'General case' 0 CA--C 1.496 -1.111 0 N-CA-C 116.793 2.145 . . . . 1.0 116.793 -166.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -66.47 -35.64 80.78 Favored 'General case' 0 N--CA 1.438 -1.074 0 O-C-N 120.737 -1.227 . . . . 1.0 111.771 169.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.3 t30 71.72 41.06 0.73 Allowed 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 127.164 2.186 . . . . 1.0 112.976 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -130.87 141.16 50.29 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 122.371 1.081 . . . . 1.0 110.063 -174.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.91 10.66 22.97 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 125.398 1.479 . . . . 1.0 113.872 -173.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -78.19 126.18 30.43 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 116.005 1.854 . . . . 1.0 116.005 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.9 pt -143.04 160.75 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.221 0 C-N-CA 128.368 2.667 . . . . 1.0 107.545 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -117.66 144.85 44.83 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 119.143 -2.223 . . . . 1.0 108.422 174.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.692 HD22 HG21 ' A' ' 34' ' ' ILE . 1.4 pt? -127.19 150.56 49.47 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 119.835 -1.791 . . . . 1.0 107.541 173.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.9 ptpt -115.31 148.94 38.62 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 119.667 -1.895 . . . . 1.0 110.883 171.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.4 t -119.45 123.52 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 106.54 -1.652 . . . . 1.0 106.54 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.03 130.1 53.64 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-O 122.639 1.209 . . . . 1.0 112.188 -173.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -88.78 -179.69 46.03 Favored Glycine 0 N--CA 1.432 -1.572 0 CA-C-O 122.928 1.293 . . . . 1.0 113.561 177.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -91.9 2.79 56.3 Favored 'General case' 0 N--CA 1.436 -1.166 0 O-C-N 121.302 -1.116 . . . . 1.0 112.967 -175.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -97.55 5.66 49.22 Favored 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 126.004 1.722 . . . . 1.0 111.373 169.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.17 5.65 89.93 Favored Glycine 0 CA--C 1.494 -1.267 0 O-C-N 120.092 -1.63 . . . . 1.0 114.542 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.6 m -88.7 139.31 30.59 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 124.382 1.073 . . . . 1.0 110.292 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 p -139.88 140.63 35.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 O-C-N 121.569 -0.707 . . . . 1.0 109.942 -169.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . 0.265 0.6 OUTLIER -129.15 138.76 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.041 0 O-C-N 119.888 -1.757 . . . . 1.0 110.571 166.477 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.401 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -118.13 149.21 41.43 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-O 124.199 1.952 . . . . 1.0 113.807 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -139.44 140.71 37.41 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.724 -1.86 . . . . 1.0 107.771 -162.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -103.88 115.87 31.24 Favored 'General case' 0 CA--C 1.493 -1.232 0 C-N-CA 126.304 1.842 . . . . 1.0 111.697 -175.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.692 HG21 HD22 ' A' ' 20' ' ' LEU . 11.0 tt -143.04 154.77 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.388 0 CA-C-O 124.917 2.294 . . . . 1.0 109.943 -152.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -115.03 153.6 30.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 111.716 -2.493 . . . . 1.0 110.26 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -65.01 -38.08 89.74 Favored 'General case' 0 N--CA 1.437 -1.098 0 N-CA-C 115.916 1.821 . . . . 1.0 115.916 -158.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -87.06 10.01 17.91 Favored 'General case' 0 N--CA 1.436 -1.168 0 O-C-N 120.916 -1.115 . . . . 1.0 113.945 175.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 52.4 m -91.8 121.77 66.53 Favored Pre-proline 0 N--CA 1.437 -1.105 0 O-C-N 119.409 -2.057 . . . . 1.0 108.265 177.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -64.08 158.2 49.19 Favored 'Trans proline' 0 N--CA 1.441 -1.617 0 C-N-CA 123.13 2.554 . . . . 1.0 115.569 -175.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.448 1.5 pp -63.23 -25.66 68.43 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 115.183 1.549 . . . . 1.0 115.183 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 78.6 p -52.68 -29.06 24.49 Favored 'General case' 0 N--CA 1.437 -1.12 0 O-C-N 120.37 -1.456 . . . . 1.0 114.469 170.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.24 -43.13 71.21 Favored 'General case' 0 N--CA 1.434 -1.244 0 O-C-N 119.819 -1.801 . . . . 1.0 112.923 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.97 -31.09 69.7 Favored 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 120.452 -1.405 . . . . 1.0 113.376 172.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.51 -43.53 98.7 Favored 'General case' 0 N--CA 1.436 -1.159 0 O-C-N 120.433 -1.417 . . . . 1.0 113.289 174.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.97 -42.57 98.6 Favored 'General case' 0 N--CA 1.435 -1.207 0 O-C-N 120.686 -1.259 . . . . 1.0 113.596 170.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.28 -37.23 86.76 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -60.21 -43.74 95.71 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 126.005 1.722 . . . . 1.0 111.695 175.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 79.5 m -62.5 -42.58 99.59 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 124.86 1.264 . . . . 1.0 114.077 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -64.57 -46.22 83.69 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 120.206 -1.558 . . . . 1.0 114.382 174.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -78.38 -43.2 28.18 Favored 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 116.078 1.881 . . . . 1.0 116.078 -178.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.0 mm100 -113.64 4.98 16.31 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 121.509 -0.744 . . . . 1.0 111.84 -166.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.38 84.1 Favored Glycine 0 CA--C 1.494 -1.251 0 N-CA-C 118.655 2.222 . . . . 1.0 118.655 161.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.5 mt -85.02 164.67 18.11 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 121.187 -1.184 . . . . 1.0 113.841 -172.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.9 m -102.2 135.68 43.37 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 120.394 -1.441 . . . . 1.0 110.709 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.2 mtp -61.82 -38.71 89.18 Favored 'General case' 0 CA--C 1.495 -1.153 0 C-N-CA 125.887 1.675 . . . . 1.0 114.308 -167.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 ptt-85 -92.67 0.73 57.47 Favored 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 125.098 1.359 . . . . 1.0 112.751 -175.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.6 mm-40 -92.73 -24.52 18.56 Favored 'General case' 0 N--CA 1.434 -1.229 0 O-C-N 120.61 -1.306 . . . . 1.0 111.002 175.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.1 pt -120.35 149.34 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 O-C-N 120.972 -1.08 . . . . 1.0 110.82 -174.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -134.41 154.97 51.09 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 107.872 -1.159 . . . . 1.0 107.872 168.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.7 m-30 -106.51 148.6 28.02 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 -175.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -142.26 155.36 45.23 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 114.834 1.42 . . . . 1.0 114.834 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -115.19 107.45 15.31 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 106.948 -1.501 . . . . 1.0 106.948 176.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.2 t70 52.71 33.32 13.66 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 114.84 1.422 . . . . 1.0 114.84 175.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.49 5.78 89.16 Favored Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 118.755 2.262 . . . . 1.0 118.755 -177.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -123.63 152.83 66.0 Favored Pre-proline 0 N--CA 1.436 -1.145 0 CA-C-O 111.748 -3.977 . . . . 1.0 103.887 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.786 57.9 Cg_exo 71.97 155.76 0.0 OUTLIER 'Trans proline' 0 N--CA 1.437 -1.827 2 C-N-CA 111.555 -5.163 . . . . 1.0 116.871 169.535 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . 0.295 5.9 pt -123.91 159.24 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.398 1 C-N-CA 135.01 5.324 . . . . 1.0 111.136 17.769 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -102.82 163.02 12.46 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 120.816 1.644 . . . . 1.0 110.62 172.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -60.98 -34.63 75.08 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 119.102 -2.248 . . . . 1.0 115.257 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.4 m -92.03 8.53 37.28 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 124.5 1.12 . . . . 1.0 111.882 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -81.8 172.74 13.0 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.302 -2.124 . . . . 1.0 108.88 163.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 47.7 p -147.03 159.69 42.17 Favored Pre-proline 0 CA--C 1.498 -1.056 0 O-C-N 119.186 -2.196 . . . . 1.0 111.985 -163.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -59.4 -32.17 96.07 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.602 2.868 . . . . 1.0 115.674 168.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.38 -46.08 81.52 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-N 119.293 0.951 . . . . 1.0 113.154 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -69.22 -41.39 77.1 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 125.507 1.523 . . . . 1.0 113.605 -177.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -79.94 -8.41 59.31 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.661 -1.275 . . . . 1.0 112.805 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.12 46.87 7.72 Favored 'General case' 0 N--CA 1.436 -1.132 0 C-N-CA 126.124 1.77 . . . . 1.0 113.753 -178.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.0 mtt -62.26 153.78 29.64 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 126.767 2.027 . . . . 1.0 114.047 173.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.59 -179.9 3.93 Favored 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.172 0.989 . . . . 1.0 109.277 -171.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -57.3 -26.6 61.13 Favored 'General case' 0 N--CA 1.436 -1.164 0 C-N-CA 127.155 2.182 . . . . 1.0 116.007 -175.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -136.54 91.37 2.65 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 107.785 -1.191 . . . . 1.0 107.785 161.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.42 161.43 19.43 Favored 'General case' 0 N--CA 1.436 -1.146 0 O-C-N 119.97 -1.706 . . . . 1.0 112.418 173.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 65.3 m -130.17 115.3 16.82 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 122.224 1.012 . . . . 1.0 110.742 -177.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 140.68 43.78 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 126.841 2.056 . . . . 1.0 108.363 -172.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -110.97 151.35 28.04 Favored 'General case' 0 N--CA 1.433 -1.279 0 O-C-N 120.008 -1.682 . . . . 1.0 110.272 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.0 t -108.66 139.56 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.097 0 O-C-N 121.026 -1.046 . . . . 1.0 110.29 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -132.43 139.78 48.16 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-O 122.102 0.953 . . . . 1.0 110.036 165.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -87.85 141.21 28.77 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 124.476 1.11 . . . . 1.0 111.482 -175.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -101.0 -141.66 0.34 Allowed 'General case' 0 N--CA 1.434 -1.242 0 C-N-CA 124.641 1.176 . . . . 1.0 113.101 -177.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -65.36 114.01 4.49 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 115.225 1.565 . . . . 1.0 115.225 -174.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 60.4 p -80.5 154.03 27.8 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.616 -1.302 . . . . 1.0 112.683 175.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.94 27.44 28.76 Favored Glycine 0 CA--C 1.493 -1.307 0 O-C-N 120.903 -1.123 . . . . 1.0 113.832 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.71 0 O-C-N 121.346 -1.091 . . . . 1.0 111.314 -178.625 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.925 0 N-CA-C 115.12 0.808 . . . . 1.0 115.12 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.253 0.4 OUTLIER -74.87 -48.28 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 N-CA-C 114.728 1.381 . . . . 1.0 114.728 -168.741 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 4.3 mt -107.82 120.13 58.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.21 0 N-CA-C 107.094 -1.447 . . . . 1.0 107.094 -172.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -102.17 116.9 33.63 Favored 'General case' 0 N--CA 1.434 -1.25 0 O-C-N 120.204 -1.56 . . . . 1.0 107.14 164.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.11 149.82 28.0 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 120.346 1.43 . . . . 1.0 114.851 -175.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 11.0 t -123.05 136.93 55.03 Favored 'General case' 0 N--CA 1.436 -1.144 0 C-N-CA 124.777 1.231 . . . . 1.0 110.14 175.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 21.2 ttt -155.66 24.07 0.39 Allowed 'General case' 0 N--CA 1.434 -1.261 0 C-N-CA 125.593 1.557 . . . . 1.0 106.889 172.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -144.95 -94.07 0.1 Allowed 'General case' 0 N--CA 1.433 -1.316 0 O-C-N 120.591 -1.318 . . . . 1.0 110.09 -157.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -153.04 26.51 0.54 Allowed 'General case' 0 N--CA 1.433 -1.297 0 C-N-CA 125.143 1.377 . . . . 1.0 108.543 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 66.19 44.07 2.66 Favored 'General case' 0 N--CA 1.435 -1.219 0 C-N-CA 127.09 2.156 . . . . 1.0 115.846 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 . . . . . 0 C--O 1.262 1.727 0 C-N-CA 124.193 0.997 . . . . 1.0 113.626 171.998 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 tpt . . . . . 0 N--CA 1.482 1.173 0 N-CA-C 110.366 -0.235 . . . . 1.0 110.366 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.16 -15.37 60.58 Favored 'General case' 0 N--CA 1.435 -1.186 0 O-C-N 119.38 -2.075 . . . . 1.0 113.408 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -92.15 2.32 56.66 Favored 'General case' 0 N--CA 1.432 -1.328 0 C-N-CA 128.118 2.567 . . . . 1.0 113.621 -174.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 57.03 170.3 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 117.684 2.476 . . . . 1.0 117.684 -176.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.8 mppt? -65.88 153.91 90.33 Favored Pre-proline 0 N--CA 1.435 -1.215 0 C-N-CA 126.299 1.839 . . . . 1.0 112.389 -179.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_exo -44.34 131.93 9.24 Favored 'Trans proline' 0 N--CA 1.442 -1.513 0 C-N-CA 124.793 3.662 . . . . 1.0 117.093 173.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -66.57 131.11 45.31 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 113.904 1.076 . . . . 1.0 113.904 -174.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -79.38 -52.61 7.86 Favored 'General case' 0 N--CA 1.433 -1.282 0 O-C-N 120.933 -1.104 . . . . 1.0 112.9 -171.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 59.74 29.09 66.6 Favored Glycine 0 N--CA 1.436 -1.339 0 N-CA-C 119.065 2.386 . . . . 1.0 119.065 165.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.1 p -119.07 138.92 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-N 119.78 1.79 . . . . 1.0 110.058 -176.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -58.92 140.69 55.18 Favored 'General case' 0 N--CA 1.436 -1.139 0 O-C-N 120.188 -1.57 . . . . 1.0 113.926 171.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.3 p -115.1 -1.24 13.07 Favored 'General case' 0 N--CA 1.436 -1.128 0 O-C-N 120.704 -1.247 . . . . 1.0 111.761 -176.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 58.56 52.68 6.75 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 115.917 1.821 . . . . 1.0 115.917 170.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.6 m120 -114.42 13.8 17.76 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.597 -1.315 . . . . 1.0 113.354 -171.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 56.98 55.45 6.1 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 125.472 1.509 . . . . 1.0 114.377 178.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -96.67 2.15 51.81 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 117.049 2.24 . . . . 1.0 117.049 -153.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -61.1 138.98 58.19 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 116.804 2.15 . . . . 1.0 116.804 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 21.7 pt -135.25 160.65 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 131.213 3.805 . . . . 1.0 106.847 -175.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -113.86 144.9 42.26 Favored 'General case' 0 N--CA 1.437 -1.114 0 O-C-N 118.818 -2.426 . . . . 1.0 110.832 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.33 157.62 46.36 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 118.476 -2.64 . . . . 1.0 105.687 175.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -119.99 150.66 40.17 Favored 'General case' 0 N--CA 1.434 -1.226 0 C-N-CA 127.32 2.248 . . . . 1.0 112.654 171.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 1.4 t -106.83 132.37 54.32 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.188 0 N-CA-C 106.242 -1.762 . . . . 1.0 106.242 169.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.66 130.15 56.18 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 121.467 0.651 . . . . 1.0 109.479 169.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.49 -179.78 34.98 Favored Glycine 0 N--CA 1.435 -1.372 0 C-N-CA 124.774 1.178 . . . . 1.0 114.69 -176.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -62.58 -38.69 91.11 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 126.565 1.946 . . . . 1.0 114.028 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -75.76 -13.47 60.3 Favored 'General case' 0 N--CA 1.435 -1.189 0 O-C-N 120.348 -1.47 . . . . 1.0 111.905 -178.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.75 1.31 55.22 Favored Glycine 0 N--CA 1.435 -1.406 0 C-N-CA 125.643 1.592 . . . . 1.0 112.899 -176.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.8 m -70.23 146.45 50.67 Favored 'General case' 0 N--CA 1.435 -1.214 0 C-N-CA 125.1 1.36 . . . . 1.0 112.123 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.85 134.86 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 C-N-CA 123.918 0.887 . . . . 1.0 111.398 -172.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.824 HG22 HG11 ' B' ' 966' ' ' VAL . 0.6 OUTLIER -129.14 138.71 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.243 -1.536 . . . . 1.0 107.852 168.279 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.528 ' H ' HG21 ' B' ' 966' ' ' VAL . 0.0 OUTLIER -114.8 158.06 22.4 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 126.538 3.066 . . . . 1.0 113.49 172.504 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.474 ' CE1' ' CG1' ' A' ' 30' ' ' VAL 0.271 25.6 m-85 -145.11 148.23 33.41 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 118.218 -2.801 . . . . 1.0 109.214 -159.575 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -116.51 115.7 26.26 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 120.496 1.498 . . . . 1.0 112.965 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 20.9 tt -150.9 154.75 8.09 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.355 0 CA-C-O 125.665 2.65 . . . . 1.0 111.538 -164.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.69 163.01 13.71 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-N 110.983 -2.826 . . . . 1.0 111.731 -172.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -69.94 -37.11 75.78 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 117.582 2.438 . . . . 1.0 117.582 -162.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -88.44 -24.32 23.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.401 -1.437 . . . . 1.0 113.174 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m -60.68 137.08 92.94 Favored Pre-proline 0 N--CA 1.438 -1.073 0 C-N-CA 126.544 1.938 . . . . 1.0 114.037 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -76.54 157.2 36.38 Favored 'Trans proline' 0 N--CA 1.441 -1.568 0 CA-C-N 123.76 2.378 . . . . 1.0 115.235 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.319 1.4 pp -62.84 -25.71 68.4 Favored 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 125.341 1.456 . . . . 1.0 114.643 179.055 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.0 t -52.8 -29.08 25.57 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 119.663 -1.898 . . . . 1.0 115.216 170.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.508 ' HG3' HD12 ' B' ' 969' ' ' LEU . 0.1 OUTLIER -70.12 -45.58 66.57 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.01 -1.681 . . . . 1.0 111.039 -170.34 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.484 HD13 ' H ' ' A' ' 43' ' ' LEU 0.332 0.0 OUTLIER -65.81 -36.5 83.67 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 115.151 1.537 . . . . 1.0 115.151 171.465 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.1 tpp -62.27 -40.66 96.95 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 114.738 1.385 . . . . 1.0 114.738 177.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -65.7 -41.11 92.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 O-C-N 120.054 -1.654 . . . . 1.0 112.793 171.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.89 -37.14 83.48 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.697 -1.252 . . . . 1.0 114.078 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.39 -44.94 89.16 Favored 'General case' 0 N--CA 1.436 -1.156 0 O-C-N 120.189 -1.569 . . . . 1.0 112.427 171.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.6 m -61.75 -39.96 93.45 Favored 'General case' 0 N--CA 1.435 -1.21 0 C-N-CA 124.126 0.97 . . . . 1.0 113.184 175.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -66.29 -47.82 72.37 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.5 1.12 . . . . 1.0 113.86 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -69.03 -43.32 74.96 Favored 'General case' 0 N--CA 1.436 -1.131 0 O-C-N 120.383 -1.448 . . . . 1.0 114.621 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.2 mm100 -114.19 8.47 16.87 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 114.302 1.223 . . . . 1.0 114.302 -163.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.03 42.23 12.68 Favored Glycine 0 CA--C 1.494 -1.264 0 N-CA-C 116.355 1.302 . . . . 1.0 116.355 163.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 30.5 mt -116.63 162.87 16.97 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 121.176 -1.191 . . . . 1.0 110.165 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 55.0 m -102.36 132.55 48.27 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 120.535 -1.353 . . . . 1.0 110.019 173.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.8 tpt -61.78 -40.67 96.01 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 126.145 1.778 . . . . 1.0 114.229 -166.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -97.62 13.21 30.93 Favored 'General case' 0 N--CA 1.434 -1.272 0 O-C-N 120.708 -1.245 . . . . 1.0 112.131 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -105.93 -7.51 18.14 Favored 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 124.22 1.008 . . . . 1.0 111.34 171.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.4 pt -111.76 136.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.159 0 O-C-N 121.095 -1.003 . . . . 1.0 110.015 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.1 mmt180 -123.79 139.03 54.38 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 120.709 -1.244 . . . . 1.0 109.54 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.432 ' HB2' HD11 ' A' ' 67' ' ' ILE . 0.1 OUTLIER -120.27 143.94 48.05 Favored 'General case' 0 N--CA 1.433 -1.323 0 O-C-N 120.675 -1.266 . . . . 1.0 111.48 -162.402 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -141.11 154.79 46.08 Favored 'General case' 0 N--CA 1.435 -1.223 0 C-N-CA 124.508 1.123 . . . . 1.0 110.445 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -133.62 117.92 17.61 Favored 'General case' 0 N--CA 1.433 -1.305 0 O-C-N 120.626 -1.296 . . . . 1.0 108.351 176.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 44.2 t0 51.62 45.05 28.7 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 126.117 1.767 . . . . 1.0 112.713 -175.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.2 0.96 72.78 Favored Glycine 0 N--CA 1.436 -1.349 0 N-CA-C 116.58 1.392 . . . . 1.0 116.58 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -112.64 128.92 24.94 Favored Pre-proline 0 N--CA 1.436 -1.125 0 O-C-N 120.027 -1.867 . . . . 1.0 110.728 -174.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -48.53 136.19 26.56 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 124.686 3.591 . . . . 1.0 117.952 170.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.432 HD11 ' HB2' ' A' ' 60' ' ' PHE . 4.3 pt -123.19 154.18 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.183 0 C-N-CA 125.36 1.464 . . . . 1.0 109.349 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -110.49 161.2 15.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 121.036 -1.04 . . . . 1.0 109.049 -171.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -65.88 -25.6 67.25 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 119.536 -1.978 . . . . 1.0 113.243 173.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 m -78.42 -18.4 55.03 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 126.531 1.932 . . . . 1.0 112.947 173.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -67.52 160.26 28.01 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-O 124.189 1.947 . . . . 1.0 112.495 174.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 66.3 p -144.31 162.22 40.85 Favored Pre-proline 0 CA--C 1.496 -1.133 0 CA-C-N 114.472 -1.24 . . . . 1.0 110.025 -158.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -60.56 -32.44 93.5 Favored 'Trans proline' 0 N--CA 1.439 -1.698 0 C-N-CA 123.2 2.6 . . . . 1.0 114.558 168.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.22 -45.73 83.52 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-O 122.264 1.03 . . . . 1.0 113.155 175.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -71.22 -44.36 65.53 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 124.735 1.214 . . . . 1.0 113.2 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.3 tp -87.75 -8.35 56.14 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 113.568 0.951 . . . . 1.0 113.568 -176.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.29 42.24 15.29 Favored 'General case' 0 N--CA 1.435 -1.214 0 C-N-CA 128.664 2.786 . . . . 1.0 115.901 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.7 mtm -69.61 154.24 42.29 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 126.861 2.065 . . . . 1.0 113.832 169.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -141.02 -175.09 4.18 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 105.919 -1.882 . . . . 1.0 105.919 -164.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.337 4.0 p-10 -50.45 -26.47 5.11 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 118.875 2.917 . . . . 1.0 118.875 -167.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -141.48 58.54 1.51 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.34 1.056 . . . . 1.0 113.062 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.98 169.35 16.87 Favored 'General case' 0 N--CA 1.436 -1.126 0 O-C-N 119.005 -2.31 . . . . 1.0 116.821 -173.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.3 m -131.87 122.12 25.17 Favored 'General case' 0 N--CA 1.439 -1.021 0 C-N-CA 124.998 1.319 . . . . 1.0 112.182 -176.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 52.8 mt -112.91 140.73 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.061 0 C-N-CA 127.65 2.38 . . . . 1.0 108.132 175.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -110.95 134.28 52.7 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 120.66 -1.275 . . . . 1.0 108.615 -177.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.69 132.96 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 C-N-CA 125.328 1.451 . . . . 1.0 107.139 -169.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -130.52 134.23 46.88 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 122.732 1.253 . . . . 1.0 110.956 177.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -88.05 140.25 29.68 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 124.988 1.315 . . . . 1.0 112.968 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -116.16 -168.02 1.37 Allowed 'General case' 0 N--CA 1.434 -1.238 0 C-N-CA 126.017 1.727 . . . . 1.0 112.162 -172.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 29.8 mp0 -62.49 146.53 51.4 Favored 'General case' 0 N--CA 1.436 -1.173 0 C-N-CA 125.779 1.632 . . . . 1.0 114.281 177.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 77.2 p -71.17 -42.97 68.38 Favored 'General case' 0 CA--C 1.496 -1.121 0 O-C-N 120.807 -1.183 . . . . 1.0 113.676 176.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.76 151.85 52.44 Favored Glycine 0 CA--C 1.493 -1.331 0 O-C-N 120.493 -1.379 . . . . 1.0 114.614 176.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.712 0 N-CA-C 109.671 -1.372 . . . . 1.0 109.671 -177.833 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.938 0 CA-C-O 120.146 -0.252 . . . . 1.0 113.114 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . 0.824 HG11 HG22 ' A' ' 30' ' ' VAL . 2.2 t -77.31 -125.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.1 0 CA-C-N 118.771 1.285 . . . . 1.0 113.391 173.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -109.56 125.19 66.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 O-C-N 118.962 -2.337 . . . . 1.0 112.763 -146.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -99.37 125.05 44.98 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.12 2.168 . . . . 1.0 110.382 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.508 HD12 ' HG3' ' A' ' 42' ' ' LYS . 2.0 mm? -108.13 145.65 33.82 Favored 'General case' 0 N--CA 1.436 -1.136 0 N-CA-C 116.165 1.913 . . . . 1.0 116.165 -173.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 72.6 p -130.97 -144.69 0.26 Allowed 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 126.642 1.977 . . . . 1.0 108.785 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . 0.364 21.0 ttp 88.46 29.96 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.145 0 C-N-CA 126.895 2.078 . . . . 1.0 115.678 167.267 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -137.49 -82.3 0.35 Allowed 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 104.27 -2.493 . . . . 1.0 104.27 167.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -110.93 177.6 4.61 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 102.704 -3.073 . . . . 1.0 102.704 147.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -65.54 -52.09 55.06 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 120.732 -1.23 . . . . 1.0 111.859 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.293 30.9 tt0 . . . . . 0 C--O 1.259 1.563 0 N-CA-C 116.221 1.934 . . . . 1.0 116.221 179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.7 mmm . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 111.399 0.148 . . . . 1.0 111.399 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.67 -41.12 96.31 Favored 'General case' 0 N--CA 1.435 -1.204 0 N-CA-C 115.94 1.829 . . . . 1.0 115.94 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -61.26 -37.26 82.48 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 116.791 2.145 . . . . 1.0 116.791 -168.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -54.99 137.04 47.06 Favored 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 115.813 1.782 . . . . 1.0 115.813 -177.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -93.75 158.87 35.81 Favored Pre-proline 0 N--CA 1.434 -1.253 0 C-N-CA 126.509 1.924 . . . . 1.0 111.33 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -43.75 149.65 0.67 Allowed 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 124.639 3.559 . . . . 1.0 117.101 163.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.0 pttm -128.05 -7.19 5.45 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 118.973 0.806 . . . . 1.0 112.069 178.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -117.2 132.05 56.73 Favored 'General case' 0 N--CA 1.434 -1.253 0 O-C-N 120.567 -1.333 . . . . 1.0 111.009 -172.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 80.07 13.51 81.95 Favored Glycine 0 N--CA 1.437 -1.252 0 O-C-N 120.523 -1.36 . . . . 1.0 114.393 -171.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -96.0 138.31 21.78 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.127 0 O-C-N 120.756 -1.438 . . . . 1.0 110.717 -170.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -125.16 148.25 48.67 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 120.758 -1.214 . . . . 1.0 108.834 169.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.9 t -156.01 -6.28 0.12 Allowed 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 116.074 1.879 . . . . 1.0 116.074 173.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -125.13 -35.53 2.63 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.148 -1.595 . . . . 1.0 111.014 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -142.12 158.68 43.47 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 120.765 -1.209 . . . . 1.0 110.215 -177.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -45.31 158.35 0.07 Allowed 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 117.702 2.482 . . . . 1.0 117.702 173.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -96.81 39.89 1.16 Allowed 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 124.85 1.26 . . . . 1.0 114.367 -179.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -71.85 139.98 49.14 Favored 'General case' 0 CA--C 1.497 -1.058 0 O-C-N 119.065 -2.272 . . . . 1.0 115.85 176.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 23.6 pt -140.35 160.76 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 C-N-CA 128.568 2.747 . . . . 1.0 105.832 175.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -109.44 144.75 37.24 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 118.838 -2.414 . . . . 1.0 107.995 168.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -137.38 147.76 45.72 Favored 'General case' 0 N--CA 1.434 -1.249 0 O-C-N 119.613 -1.93 . . . . 1.0 106.988 175.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -116.83 150.59 38.12 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 125.6 1.56 . . . . 1.0 113.022 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.453 HG23 HD11 ' A' ' 43' ' ' LEU . 9.9 t -111.78 125.98 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.206 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 170.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -123.34 134.48 54.02 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-O 122.406 1.098 . . . . 1.0 112.593 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.7 -156.85 19.92 Favored Glycine 0 CA--C 1.492 -1.398 0 O-C-N 120.744 -1.222 . . . . 1.0 111.319 177.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 55.11 40.45 31.85 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 116.638 2.088 . . . . 1.0 116.638 164.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 t70 66.96 43.09 2.28 Favored 'General case' 0 N--CA 1.434 -1.246 0 C-N-CA 126.255 1.822 . . . . 1.0 112.784 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.51 24.82 25.08 Favored Glycine 0 N--CA 1.436 -1.309 0 O-C-N 120.798 -1.189 . . . . 1.0 115.213 174.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -101.26 127.95 47.62 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-O 122.669 1.223 . . . . 1.0 110.064 173.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.4 t -139.87 137.63 38.79 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 O-C-N 120.669 -1.27 . . . . 1.0 109.195 -166.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.18 138.73 53.69 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 O-C-N 120.236 -1.54 . . . . 1.0 110.383 169.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.12 145.05 50.12 Favored 'General case' 0 CA--C 1.492 -1.276 0 CA-C-O 123.183 1.468 . . . . 1.0 112.696 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.621 ' CD2' HG21 ' B' ' 967' ' ' ILE 0.342 0.5 OUTLIER -144.41 140.61 29.11 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.118 -1.614 . . . . 1.0 108.627 -158.274 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.323 35.6 ttpt -110.96 115.5 29.59 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 123.428 1.585 . . . . 1.0 112.037 -170.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.72 HD11 HG21 ' A' ' 38' ' ' THR . 4.6 tp -154.81 154.83 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 127.498 3.523 . . . . 1.0 112.624 -163.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.706 ' H ' HD12 ' A' ' 34' ' ' ILE . 11.4 mptt -64.12 142.88 58.25 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 109.414 -3.539 . . . . 1.0 113.685 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.9 ttt-85 -71.2 -28.48 64.25 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 114.168 -1.378 . . . . 1.0 113.516 -173.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 43.2 p-80 -76.21 -29.84 57.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 115.648 1.721 . . . . 1.0 115.648 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.72 HG21 HD11 ' A' ' 34' ' ' ILE . 75.0 m -62.49 141.26 96.68 Favored Pre-proline 0 N--CA 1.439 -1.004 0 C-N-CA 127.425 2.29 . . . . 1.0 114.288 -175.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -56.27 145.93 74.89 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 123.957 3.104 . . . . 1.0 116.797 174.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.426 HD21 ' O ' ' A' ' 68' ' ' ASN 0.291 1.3 pt? -63.74 -25.61 68.27 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 114.498 1.296 . . . . 1.0 114.498 172.108 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.8 t -52.64 -29.13 24.58 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 125.787 1.635 . . . . 1.0 114.62 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -65.77 -42.47 90.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.314 -2.116 . . . . 1.0 112.553 176.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.453 HD11 HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -62.87 -41.58 99.44 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 126.441 1.896 . . . . 1.0 114.463 171.411 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 77.0 mtp -57.31 -45.9 83.75 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 113.578 0.955 . . . . 1.0 113.578 176.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -66.35 -40.2 89.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 120.456 -1.403 . . . . 1.0 113.044 173.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.65 -36.34 83.41 Favored 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.563 -1.336 . . . . 1.0 114.054 178.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -61.58 -42.28 98.63 Favored 'General case' 0 N--CA 1.437 -1.11 0 O-C-N 120.21 -1.556 . . . . 1.0 110.83 172.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 76.8 m -61.35 -46.34 90.65 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.135 1.532 . . . . 1.0 115.135 173.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -69.55 -49.85 50.47 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 115.873 1.805 . . . . 1.0 115.873 176.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -70.63 -38.18 73.88 Favored 'General case' 0 CA--C 1.493 -1.236 0 C-N-CA 125.632 1.573 . . . . 1.0 113.877 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.96 10.95 20.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 O-C-N 121.509 -0.745 . . . . 1.0 111.676 -170.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.81 44.75 24.06 Favored Glycine 0 CA--C 1.493 -1.342 0 N-CA-C 116.756 1.462 . . . . 1.0 116.756 161.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.2 mt -121.66 154.47 36.79 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 121.469 -1.019 . . . . 1.0 110.957 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.0 m -100.14 136.27 40.29 Favored 'General case' 0 N--CA 1.435 -1.188 0 O-C-N 120.514 -1.366 . . . . 1.0 109.923 174.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.4 tpt -59.55 -35.05 73.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.86 2.064 . . . . 1.0 114.055 -176.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ptt-85 -90.0 4.15 51.04 Favored 'General case' 0 N--CA 1.433 -1.285 0 C-N-CA 126.203 1.801 . . . . 1.0 111.151 -174.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -103.02 -14.49 16.44 Favored 'General case' 0 N--CA 1.432 -1.367 0 O-C-N 121.024 -1.047 . . . . 1.0 111.854 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.6 pt -127.76 159.97 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 119.897 1.226 . . . . 1.0 112.282 -166.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -138.31 147.71 43.85 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 108.201 -1.037 . . . . 1.0 108.201 169.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.458 ' HB3' HD11 ' A' ' 67' ' ' ILE . 63.5 m-85 -104.6 144.57 31.52 Favored 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 126.455 1.902 . . . . 1.0 107.438 -172.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.687 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 7.5 tmm_? -152.19 144.81 24.21 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 -167.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.687 ' CG ' ' HA ' ' A' ' 61' ' ' ARG 0.804 0.0 OUTLIER -123.1 142.63 50.67 Favored 'General case' 0 N--CA 1.408 -2.566 1 N-CA-C 94.606 -6.072 . . . . 1.0 94.606 -122.145 . . . . . . . . 5 4 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -69.83 74.68 0.44 Allowed 'General case' 0 N--CA 1.438 -1.038 0 O-C-N 119.747 -1.845 . . . . 1.0 115.434 -159.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.42 3.93 78.73 Favored Glycine 0 N--CA 1.433 -1.518 0 C-N-CA 127.639 2.542 . . . . 1.0 112.251 -159.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.632 ' O ' ' HB2' ' A' ' 62' ' ' PHE . 53.4 mt-30 -123.75 153.22 66.77 Favored Pre-proline 0 N--CA 1.428 -1.532 1 N-CA-C 99.719 -4.178 . . . . 1.0 99.719 -158.3 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.65 ' HA ' ' CG ' ' A' ' 62' ' ' PHE . 55.5 Cg_endo -72.12 135.97 26.1 Favored 'Trans proline' 0 N--CA 1.444 -1.406 1 C-N-CA 125.457 4.105 . . . . 1.0 116.295 148.22 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.567 HG12 ' HB3' ' A' ' 62' ' ' PHE . 5.8 pt -117.59 127.24 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.117 0 C-N-CA 126.897 2.079 . . . . 1.0 108.976 171.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.426 ' O ' HD21 ' A' ' 40' ' ' LEU . 39.4 m-80 -112.8 158.75 19.74 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 125.381 1.473 . . . . 1.0 108.772 175.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -59.99 -25.32 65.15 Favored 'General case' 0 N--CA 1.438 -1.056 0 O-C-N 118.9 -2.375 . . . . 1.0 116.947 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 m -92.35 -2.27 56.49 Favored 'General case' 0 N--CA 1.437 -1.103 0 O-C-N 120.622 -1.299 . . . . 1.0 111.351 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -73.18 171.81 12.28 Favored 'General case' 0 N--CA 1.432 -1.331 0 O-C-N 119.311 -2.118 . . . . 1.0 111.988 172.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 64.9 p -146.34 154.41 49.37 Favored Pre-proline 0 CA--C 1.495 -1.141 0 O-C-N 120.097 -1.627 . . . . 1.0 109.415 -162.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.404 ' HB3' ' HB2' ' A' ' 78' ' ' MET . 39.7 Cg_exo -58.16 -31.64 93.8 Favored 'Trans proline' 0 N--CA 1.44 -1.672 0 C-N-CA 123.272 2.648 . . . . 1.0 116.078 170.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.15 -45.09 89.99 Favored 'General case' 0 N--CA 1.434 -1.256 0 N-CA-C 113.929 1.085 . . . . 1.0 113.929 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -74.35 -41.11 61.59 Favored 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.966 1.306 . . . . 1.0 113.306 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.78 -8.49 59.7 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-O 122.124 0.964 . . . . 1.0 112.665 178.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.289 42.2 mm-40 64.43 48.16 2.82 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 126.204 1.802 . . . . 1.0 114.416 177.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.404 ' HB2' ' HB3' ' A' ' 73' ' ' PRO . 66.2 mtt -82.05 154.25 25.72 Favored 'General case' 0 N--CA 1.433 -1.314 0 C-N-CA 127.03 2.132 . . . . 1.0 111.06 172.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -125.89 -178.98 4.47 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 121.062 -1.024 . . . . 1.0 109.396 -164.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.376 9.1 p-10 -54.1 -26.55 27.75 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 117.217 2.303 . . . . 1.0 117.217 -174.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -135.75 89.49 2.5 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 123.277 0.631 . . . . 1.0 111.366 158.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.7 170.53 10.06 Favored 'General case' 0 N--CA 1.439 -1.022 0 N-CA-C 116.765 2.135 . . . . 1.0 116.765 178.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 5.9 m -135.87 120.95 18.84 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 125.008 1.323 . . . . 1.0 112.473 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 96.8 mt -110.22 140.78 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.106 0 C-N-CA 129.972 3.309 . . . . 1.0 108.31 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -110.82 146.43 36.43 Favored 'General case' 0 N--CA 1.434 -1.23 0 O-C-N 119.939 -1.726 . . . . 1.0 108.693 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.4 t -121.18 139.69 47.59 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.218 0 O-C-N 121.17 -0.956 . . . . 1.0 108.969 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -128.58 143.24 50.92 Favored 'General case' 0 N--CA 1.436 -1.17 0 O-C-N 121.367 -0.833 . . . . 1.0 111.14 163.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -87.16 130.27 34.6 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.739 1.257 . . . . 1.0 112.76 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -102.07 -22.69 14.19 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 125.169 1.387 . . . . 1.0 111.147 -179.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . 0.318 22.0 pt20 50.94 40.29 24.85 Favored 'General case' 0 N--CA 1.436 -1.13 0 C-N-CA 128.954 2.901 . . . . 1.0 117.853 173.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 21.0 p -81.42 -47.07 13.7 Favored 'General case' 0 N--CA 1.436 -1.133 0 O-C-N 120.264 -1.522 . . . . 1.0 112.799 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -86.93 -176.83 49.23 Favored Glycine 0 N--CA 1.436 -1.328 0 O-C-N 120.737 -1.227 . . . . 1.0 112.006 169.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.742 0 O-C-N 121.463 -1.022 . . . . 1.0 110.606 175.338 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.951 0 N-CA-C 114.784 0.674 . . . . 1.0 114.784 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 16.5 t -74.92 -57.91 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.134 0 CA-C-O 123.978 1.847 . . . . 1.0 114.012 -171.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . 0.621 HG21 ' CD2' ' A' ' 32' ' ' PHE . 6.5 mt -113.05 111.01 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 C-N-CA 127.127 2.171 . . . . 1.0 110.808 -171.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -102.18 109.08 20.67 Favored 'General case' 0 N--CA 1.437 -1.095 0 O-C-N 119.172 -2.205 . . . . 1.0 112.703 171.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.501 ' CD1' HD13 ' A' ' 34' ' ' ILE 0.275 0.4 OUTLIER -102.83 156.05 17.92 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 122.713 2.506 . . . . 1.0 114.433 -172.101 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 69.1 p -111.92 17.11 20.02 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 126.1 1.76 . . . . 1.0 111.316 -170.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 22.7 ttt -57.88 -33.94 69.25 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 116.37 1.989 . . . . 1.0 116.37 -174.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -144.36 145.08 31.75 Favored 'General case' 0 N--CA 1.432 -1.332 0 O-C-N 120.88 -1.138 . . . . 1.0 109.817 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 1.1 t70 52.84 -143.96 0.67 Allowed 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 115.595 1.702 . . . . 1.0 115.595 162.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -87.51 132.7 33.94 Favored 'General case' 0 N--CA 1.434 -1.253 0 C-N-CA 128.131 2.573 . . . . 1.0 109.344 176.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 . . . . . 0 C--O 1.261 1.709 0 N-CA-C 116.667 2.099 . . . . 1.0 116.667 -165.737 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.8 mtp . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 112.308 0.484 . . . . 1.0 112.308 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.18 -42.87 83.51 Favored 'General case' 0 N--CA 1.435 -1.205 0 O-C-N 120.857 -1.152 . . . . 1.0 113.667 178.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -128.88 119.09 23.81 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 126.03 1.732 . . . . 1.0 107.733 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -98.87 -12.74 20.49 Favored 'General case' 0 N--CA 1.435 -1.202 0 O-C-N 120.23 -1.544 . . . . 1.0 113.262 -169.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -64.65 137.99 97.31 Favored Pre-proline 0 N--CA 1.436 -1.163 0 O-C-N 120.318 -1.489 . . . . 1.0 114.445 -178.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.27 142.63 19.19 Favored 'Trans proline' 0 N--CA 1.442 -1.546 0 C-N-CA 122.651 2.234 . . . . 1.0 113.037 -164.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -106.82 -2.2 21.68 Favored 'General case' 0 N--CA 1.435 -1.191 0 C-N-CA 124.156 0.983 . . . . 1.0 111.604 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -59.9 152.53 23.22 Favored 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 117.458 2.392 . . . . 1.0 117.458 178.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -85.28 179.6 50.71 Favored Glycine 0 N--CA 1.437 -1.259 0 O-C-N 120.848 -1.158 . . . . 1.0 111.898 161.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.3 p -68.87 142.29 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.105 0 O-C-N 120.705 -1.468 . . . . 1.0 113.991 -178.085 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -111.67 6.45 19.9 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 119.716 -1.865 . . . . 1.0 112.454 -174.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 62.5 p -112.82 145.29 40.9 Favored 'General case' 0 N--CA 1.436 -1.164 0 O-C-N 120.602 -1.311 . . . . 1.0 111.149 -175.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -63.08 -45.9 89.97 Favored 'General case' 0 N--CA 1.435 -1.19 0 C-N-CA 124.309 1.044 . . . . 1.0 113.362 -175.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -148.87 147.12 28.34 Favored 'General case' 0 N--CA 1.435 -1.22 0 N-CA-C 107.454 -1.313 . . . . 1.0 107.454 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -64.39 145.47 56.0 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 115.206 1.558 . . . . 1.0 115.206 -173.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -105.49 13.87 29.48 Favored 'General case' 0 N--CA 1.436 -1.148 0 C-N-CA 126.439 1.896 . . . . 1.0 115.12 -178.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -65.68 151.52 46.34 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 115.511 1.671 . . . . 1.0 115.511 175.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -140.66 160.68 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 C-N-CA 127.306 2.242 . . . . 1.0 109.158 -172.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -117.72 144.77 44.96 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 118.87 -2.393 . . . . 1.0 109.127 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -127.91 157.49 40.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 O-C-N 119.136 -2.227 . . . . 1.0 106.159 167.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 14.4 ptpt -109.35 150.6 27.78 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 125.578 1.551 . . . . 1.0 110.539 161.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.417 HG22 ' HB ' ' A' ' 84' ' ' ILE . 39.4 t -116.94 124.93 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.274 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 171.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -125.06 130.13 51.66 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-O 122.654 1.216 . . . . 1.0 111.837 -176.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.404 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -88.3 -177.82 47.2 Favored Glycine 0 N--CA 1.434 -1.472 0 CA-C-O 122.763 1.202 . . . . 1.0 115.727 -176.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.11 -25.59 66.28 Favored 'General case' 0 N--CA 1.434 -1.23 0 C-N-CA 125.653 1.581 . . . . 1.0 114.723 -175.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 55.6 p30 -94.64 1.55 55.58 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 124.662 1.185 . . . . 1.0 111.907 173.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.95 4.85 71.63 Favored Glycine 0 CA--C 1.493 -1.319 0 O-C-N 120.489 -1.382 . . . . 1.0 115.086 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 m -70.25 128.1 35.07 Favored 'General case' 0 CA--C 1.495 -1.151 0 CA-C-N 119.0 1.4 . . . . 1.0 113.206 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -130.51 137.18 56.8 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-O 122.297 1.046 . . . . 1.0 113.26 -163.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -129.24 138.81 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.07 0 O-C-N 119.776 -1.827 . . . . 1.0 109.637 160.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -119.96 139.5 52.37 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-O 123.163 1.459 . . . . 1.0 112.309 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.521 ' HB3' ' HB ' ' B' ' 967' ' ' ILE . 0.0 OUTLIER -145.05 142.57 29.84 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.412 -1.43 . . . . 1.0 113.949 -163.061 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.427 ' O ' HD23 ' B' ' 969' ' ' LEU 0.305 14.0 ttpt -109.34 115.71 30.48 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.696 1.236 . . . . 1.0 114.2 -167.246 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 14.0 tt -146.28 154.75 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.461 0 CA-C-O 126.183 2.897 . . . . 1.0 110.012 -152.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.477 ' HE2' ' HA ' ' B' ' 973' ' ' ASP . 8.5 mtpp -107.65 158.07 17.56 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 110.768 -2.923 . . . . 1.0 111.413 -171.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -68.96 -37.99 79.14 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 117.275 2.324 . . . . 1.0 117.275 -151.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -87.95 -12.08 45.66 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 120.683 -1.26 . . . . 1.0 113.658 -176.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 94.6 m -60.1 144.28 87.17 Favored Pre-proline 0 N--CA 1.437 -1.077 0 C-N-CA 128.091 2.556 . . . . 1.0 114.315 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -65.66 148.9 87.51 Favored 'Trans proline' 0 N--CA 1.44 -1.647 0 CA-C-N 124.935 2.798 . . . . 1.0 116.04 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.572 ' HA ' HD22 ' A' ' 43' ' ' LEU 0.368 0.6 OUTLIER -64.06 -25.66 68.21 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 115.266 1.58 . . . . 1.0 115.266 169.354 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.1 t -52.49 -29.04 22.94 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 126.917 2.087 . . . . 1.0 112.603 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.3 ttpt -67.5 -36.87 81.9 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 120.431 -1.418 . . . . 1.0 111.822 -178.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.572 HD22 ' HA ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -64.08 -42.25 97.02 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 125.036 1.335 . . . . 1.0 112.144 172.015 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 ttm -58.39 -43.14 88.41 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 113.96 1.096 . . . . 1.0 113.96 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.19 -41.97 94.02 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.258 1.023 . . . . 1.0 112.429 173.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -38.6 90.43 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.525 -1.359 . . . . 1.0 114.459 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.472 ' CE2' HD12 ' A' ' 53' ' ' LEU . 12.5 t80 -60.98 -41.28 96.15 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 126.37 1.868 . . . . 1.0 111.769 173.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 85.2 m -62.92 -45.11 94.04 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.802 -1.186 . . . . 1.0 113.987 171.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -64.52 -51.74 61.34 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 119.944 -1.723 . . . . 1.0 114.618 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -76.43 -43.27 40.91 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 115.028 1.492 . . . . 1.0 115.028 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.63 2.25 25.8 Favored 'General case' 0 N--CA 1.435 -1.194 0 O-C-N 121.289 -0.882 . . . . 1.0 110.602 -166.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.54 7.94 85.54 Favored Glycine 0 CA--C 1.493 -1.316 0 N-CA-C 117.576 1.79 . . . . 1.0 117.576 164.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.472 HD12 ' CE2' ' A' ' 47' ' ' TYR . 10.1 mt -83.79 166.76 17.72 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 119.165 1.482 . . . . 1.0 113.577 -172.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 67.1 m -102.28 131.47 48.84 Favored 'General case' 0 N--CA 1.436 -1.162 0 O-C-N 120.519 -1.363 . . . . 1.0 112.052 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 22.5 ptp -66.51 -30.38 70.69 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 115.918 1.822 . . . . 1.0 115.918 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.8 ptt85 -75.18 -18.51 60.15 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 120.187 -1.571 . . . . 1.0 113.54 175.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -93.85 -10.62 33.38 Favored 'General case' 0 N--CA 1.435 -1.216 0 O-C-N 120.874 -1.141 . . . . 1.0 112.812 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 19.6 pt -114.15 146.5 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.196 0 C-N-CA 124.233 1.013 . . . . 1.0 111.204 -174.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -136.93 137.08 39.18 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 120.731 -1.231 . . . . 1.0 108.479 167.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -103.27 148.62 25.61 Favored 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.024 -1.048 . . . . 1.0 111.227 -174.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -138.7 162.09 35.54 Favored 'General case' 0 N--CA 1.433 -1.276 0 O-C-N 120.97 -1.081 . . . . 1.0 109.864 174.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -115.33 110.04 18.8 Favored 'General case' 0 N--CA 1.433 -1.304 0 N-CA-C 108.561 -0.903 . . . . 1.0 108.561 164.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.5 t0 41.29 55.65 3.28 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.303 2.241 . . . . 1.0 114.738 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 2.32 90.64 Favored Glycine 0 N--CA 1.435 -1.368 0 N-CA-C 117.691 1.836 . . . . 1.0 117.691 -176.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -109.87 119.64 47.01 Favored Pre-proline 0 N--CA 1.435 -1.175 0 CA-C-N 120.954 2.377 . . . . 1.0 110.786 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -46.61 136.98 15.8 Favored 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 124.525 3.483 . . . . 1.0 117.391 165.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.4 pt -123.26 153.56 28.65 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 C-N-CA 125.132 1.373 . . . . 1.0 107.878 177.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -112.6 162.15 16.0 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 120.612 -1.305 . . . . 1.0 110.747 -172.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -73.93 -15.25 61.13 Favored 'General case' 0 N--CA 1.436 -1.135 0 O-C-N 119.16 -2.212 . . . . 1.0 115.058 -176.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.8 m -95.16 -3.64 47.52 Favored 'General case' 0 N--CA 1.438 -1.066 0 O-C-N 120.606 -1.309 . . . . 1.0 111.65 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -73.1 169.98 15.87 Favored 'General case' 0 N--CA 1.435 -1.201 0 O-C-N 118.22 -2.8 . . . . 1.0 111.369 169.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 53.2 p -148.32 160.52 36.65 Favored Pre-proline 0 CA--C 1.495 -1.146 0 O-C-N 119.707 -1.871 . . . . 1.0 110.125 -157.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -58.51 -34.52 98.85 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.301 2.667 . . . . 1.0 114.748 167.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.1 -45.99 75.55 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 114.118 1.155 . . . . 1.0 114.118 175.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -70.41 -39.06 74.68 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 125.115 1.366 . . . . 1.0 114.056 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 21.6 tp -86.9 -8.49 57.22 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 120.759 -1.213 . . . . 1.0 112.355 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.263 40.7 mt-10 61.97 43.86 8.74 Favored 'General case' 0 N--CA 1.433 -1.28 0 C-N-CA 126.64 1.976 . . . . 1.0 114.382 177.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 58.2 mtt -57.23 154.19 10.72 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 128.262 2.625 . . . . 1.0 113.052 167.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -116.99 -177.44 3.2 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 120.981 -1.074 . . . . 1.0 108.848 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.373 10.4 p-10 -57.74 -26.6 62.06 Favored 'General case' 0 N--CA 1.435 -1.197 0 C-N-CA 126.318 1.847 . . . . 1.0 115.636 -178.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -139.15 85.94 2.1 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.13 1.772 . . . . 1.0 110.344 166.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.28 165.37 16.5 Favored 'General case' 0 N--CA 1.437 -1.102 0 O-C-N 120.432 -1.417 . . . . 1.0 113.807 175.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 69.5 m -132.01 121.37 23.79 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 125.216 1.406 . . . . 1.0 110.677 172.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.417 ' HB ' HG22 ' A' ' 22' ' ' VAL . 46.2 mm -115.55 140.68 35.98 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 C-N-CA 127.134 2.174 . . . . 1.0 109.315 -178.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -111.16 139.83 46.22 Favored 'General case' 0 N--CA 1.434 -1.241 0 O-C-N 120.193 -1.567 . . . . 1.0 111.97 -164.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.404 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 9.9 t -113.15 133.61 58.46 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.184 0 CA-C-O 122.766 1.27 . . . . 1.0 111.165 -178.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -116.74 138.11 51.71 Favored 'General case' 0 N--CA 1.433 -1.279 0 CA-C-O 122.554 1.169 . . . . 1.0 110.651 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.7 mm100 -89.43 137.01 32.7 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 124.242 1.017 . . . . 1.0 111.195 -175.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -100.8 164.74 11.71 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 115.219 1.562 . . . . 1.0 115.219 -174.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -124.43 137.16 54.47 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.685 -1.143 . . . . 1.0 111.609 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.7 t -154.03 169.2 24.07 Favored 'General case' 0 N--CA 1.437 -1.1 0 O-C-N 120.858 -1.151 . . . . 1.0 109.717 -175.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.93 12.08 84.77 Favored Glycine 0 N--CA 1.437 -1.29 0 O-C-N 119.714 -1.866 . . . . 1.0 116.502 173.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.754 0 O-C-N 121.032 -1.275 . . . . 1.0 110.528 -175.16 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.87 0 N-CA-C 113.503 0.161 . . . . 1.0 113.503 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . . 11.2 t -75.15 -57.82 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 CA-C-O 123.494 1.616 . . . . 1.0 113.974 -173.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . 0.521 ' HB ' ' HB3' ' A' ' 32' ' ' PHE . 7.0 mt -113.21 129.09 69.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 C-N-CA 127.454 2.302 . . . . 1.0 113.298 -165.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -102.08 129.59 48.46 Favored 'General case' 0 N--CA 1.435 -1.187 0 O-C-N 120.292 -1.505 . . . . 1.0 108.174 167.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.427 HD23 ' O ' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -74.0 167.94 20.51 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 117.919 2.563 . . . . 1.0 117.919 -170.308 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 13.7 p -140.36 175.83 9.27 Favored 'General case' 0 N--CA 1.437 -1.075 0 C-N-CA 129.143 2.977 . . . . 1.0 107.684 -175.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 32.8 ttp 72.82 54.39 0.14 Allowed 'General case' 0 N--CA 1.439 -1.008 0 O-C-N 119.597 -1.939 . . . . 1.0 114.515 176.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 27.6 t0 83.48 12.96 0.39 Allowed 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 127.953 2.501 . . . . 1.0 111.726 -176.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . 0.477 ' HA ' ' HE2' ' A' ' 35' ' ' LYS . 1.1 m-20 -113.11 69.62 0.7 Allowed 'General case' 0 N--CA 1.428 -1.539 0 CA-C-O 122.513 1.149 . . . . 1.0 108.596 174.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -62.89 -43.98 97.34 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 116.33 1.974 . . . . 1.0 116.33 -171.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 . . . . . 0 C--O 1.261 1.68 0 C-N-CA 127.561 2.344 . . . . 1.0 110.823 -179.999 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 tpt . . . . . 0 N--CA 1.483 1.21 0 N-CA-C 113.555 0.946 . . . . 1.0 113.555 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.12 -44.97 94.49 Favored 'General case' 0 N--CA 1.436 -1.163 0 N-CA-C 115.873 1.805 . . . . 1.0 115.873 -174.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -65.69 -47.13 76.45 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.86 -1.15 . . . . 1.0 113.745 177.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -97.68 -4.57 37.06 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 114.949 1.463 . . . . 1.0 114.949 -166.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -68.34 147.75 98.21 Favored Pre-proline 0 N--CA 1.436 -1.166 0 O-C-N 119.904 -1.747 . . . . 1.0 113.433 169.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -55.72 129.78 36.86 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 124.413 3.408 . . . . 1.0 116.996 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -66.2 147.89 52.65 Favored 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 124.717 1.207 . . . . 1.0 113.704 170.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -130.41 130.79 44.78 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 121.13 -0.982 . . . . 1.0 112.863 -165.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 83.2 21.37 58.94 Favored Glycine 0 N--CA 1.437 -1.241 0 N-CA-C 116.72 1.448 . . . . 1.0 116.72 167.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.5 t -65.58 -42.64 93.42 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 O-C-N 121.034 -1.274 . . . . 1.0 113.911 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -62.32 140.41 58.51 Favored 'General case' 0 N--CA 1.437 -1.115 0 N-CA-C 115.329 1.603 . . . . 1.0 115.329 176.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.3 t -156.81 156.18 32.8 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 175.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.272 46.6 mt-10 61.88 159.11 0.06 Allowed 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 126.533 1.933 . . . . 1.0 114.739 -162.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.0 m120 54.16 56.72 6.66 Favored 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 116.121 1.897 . . . . 1.0 116.121 173.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -148.7 173.7 12.95 Favored 'General case' 0 N--CA 1.434 -1.243 0 O-C-N 120.949 -1.094 . . . . 1.0 110.188 -173.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -109.11 19.44 19.5 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.878 -1.138 . . . . 1.0 113.135 -176.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.5 m170 -76.17 140.33 41.67 Favored 'General case' 0 N--CA 1.437 -1.121 0 O-C-N 120.549 -1.344 . . . . 1.0 112.618 178.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 24.7 pt -143.03 160.65 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.247 0 C-N-CA 126.394 1.877 . . . . 1.0 106.951 170.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -117.71 144.8 44.92 Favored 'General case' 0 N--CA 1.432 -1.33 0 O-C-N 119.3 -2.125 . . . . 1.0 108.982 176.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -127.5 146.04 50.64 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 119.938 -1.726 . . . . 1.0 107.455 168.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 31' ' ' GLN . 11.9 ptpt -106.45 150.62 25.89 Favored 'General case' 0 CA--C 1.493 -1.22 0 O-C-N 120.111 -1.618 . . . . 1.0 111.311 165.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.4 p -119.22 124.52 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.283 0 N-CA-C 107.106 -1.442 . . . . 1.0 107.106 172.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -127.31 130.2 49.07 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 123.083 1.42 . . . . 1.0 112.739 -171.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -87.86 -179.02 47.59 Favored Glycine 0 N--CA 1.434 -1.442 0 CA-C-O 123.256 1.476 . . . . 1.0 115.801 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -91.36 -8.88 46.78 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 126.797 2.039 . . . . 1.0 109.474 175.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -112.3 7.27 19.26 Favored 'General case' 0 N--CA 1.433 -1.315 0 C-N-CA 127.761 2.424 . . . . 1.0 111.498 -173.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.43 3.88 90.54 Favored Glycine 0 N--CA 1.436 -1.316 0 N-CA-C 116.839 1.495 . . . . 1.0 116.839 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -82.09 127.99 33.67 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 118.55 1.175 . . . . 1.0 111.656 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.4 t -139.86 140.11 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 O-C-N 121.286 -0.884 . . . . 1.0 110.922 -170.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -128.04 137.88 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.089 0 N-CA-C 106.08 -1.822 . . . . 1.0 106.08 163.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.43 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -117.73 140.15 50.07 Favored 'General case' 0 CA--C 1.493 -1.248 0 CA-C-O 123.61 1.671 . . . . 1.0 111.269 161.66 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.56 ' CD2' HG21 ' B' ' 967' ' ' ILE 0.355 10.8 t80 -139.91 140.48 36.44 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 -155.141 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.279 27.3 ttpt -115.02 115.64 27.16 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-O 122.403 1.097 . . . . 1.0 111.013 -171.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.402 HD12 ' HE1' ' A' ' 32' ' ' PHE . 3.1 tt -140.09 154.7 23.46 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 CA-C-O 124.216 1.96 . . . . 1.0 111.997 -155.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -100.24 157.3 16.69 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-O 123.282 1.515 . . . . 1.0 111.758 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.1 ttt-85 -71.25 -23.12 61.93 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 117.848 2.536 . . . . 1.0 117.848 -154.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -90.44 -19.68 23.62 Favored 'General case' 0 N--CA 1.436 -1.152 0 O-C-N 120.039 -1.663 . . . . 1.0 112.438 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 18.5 m -60.9 140.45 93.62 Favored Pre-proline 0 N--CA 1.437 -1.105 0 C-N-CA 126.33 1.852 . . . . 1.0 114.132 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -68.62 152.05 74.76 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 CA-C-N 124.052 2.483 . . . . 1.0 116.308 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.291 0.4 OUTLIER -69.06 -25.47 64.47 Favored 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 126.657 1.983 . . . . 1.0 112.41 168.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 89.9 p -52.69 -29.15 25.02 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 119.098 -2.251 . . . . 1.0 115.024 173.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -67.74 -36.07 79.88 Favored 'General case' 0 N--CA 1.427 -1.614 0 O-C-N 119.75 -1.844 . . . . 1.0 110.686 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.431 ' HA ' ' CE2' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -63.57 -41.94 98.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 127.553 2.341 . . . . 1.0 112.497 171.011 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 56.1 ttm -61.53 -44.49 96.96 Favored 'General case' 0 N--CA 1.433 -1.28 0 O-C-N 120.857 -1.152 . . . . 1.0 113.7 174.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -67.21 -40.08 86.4 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 121.226 -0.921 . . . . 1.0 112.747 176.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.412 ' HB1' HD13 ' B' ' 967' ' ' ILE . . . -64.99 -38.6 91.49 Favored 'General case' 0 N--CA 1.435 -1.209 0 O-C-N 120.763 -1.21 . . . . 1.0 113.686 179.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -59.77 -40.11 87.1 Favored 'General case' 0 N--CA 1.435 -1.212 0 C-N-CA 126.218 1.807 . . . . 1.0 111.907 170.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 80.9 m -67.72 -44.4 77.74 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.629 -1.92 . . . . 1.0 114.489 172.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.42 -46.51 76.26 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.054 -1.654 . . . . 1.0 114.045 179.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 24.6 mtt180 -78.59 -42.19 29.71 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 116.572 2.064 . . . . 1.0 116.572 177.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.15 4.83 25.29 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 120.8 -1.187 . . . . 1.0 112.001 -166.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.11 5.72 85.46 Favored Glycine 0 N--CA 1.438 -1.22 0 N-CA-C 117.856 1.902 . . . . 1.0 117.856 164.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 21.0 mt -82.15 165.5 20.47 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.916 -1.344 . . . . 1.0 113.748 -173.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -102.34 129.71 48.87 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 120.326 -1.484 . . . . 1.0 111.036 171.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -66.47 -22.52 66.2 Favored 'General case' 0 N--CA 1.437 -1.081 0 O-C-N 119.835 -1.791 . . . . 1.0 115.464 -172.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -91.29 3.87 53.77 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 124.937 1.295 . . . . 1.0 112.513 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -112.91 -6.12 13.8 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 124.622 1.169 . . . . 1.0 112.4 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 31.6 pt -124.35 142.46 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.151 0 O-C-N 120.694 -1.253 . . . . 1.0 110.263 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -138.21 154.93 49.09 Favored 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 124.86 1.264 . . . . 1.0 108.159 172.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -116.04 148.71 39.9 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-O 123.028 1.394 . . . . 1.0 112.923 -167.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -136.3 152.55 50.81 Favored 'General case' 0 N--CA 1.432 -1.357 0 CA-C-O 122.421 1.105 . . . . 1.0 110.072 175.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -130.55 111.58 12.38 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 124.728 1.211 . . . . 1.0 108.733 -178.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.8 t70 48.63 44.85 21.42 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 126.409 1.883 . . . . 1.0 113.997 -174.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.5 1.69 88.96 Favored Glycine 0 N--CA 1.436 -1.323 0 N-CA-C 117.051 1.58 . . . . 1.0 117.051 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -109.96 137.7 20.56 Favored Pre-proline 0 N--CA 1.436 -1.175 0 CA-C-N 119.978 1.889 . . . . 1.0 110.365 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.74 144.99 36.05 Favored 'Trans proline' 0 N--CA 1.44 -1.659 0 C-N-CA 122.616 2.211 . . . . 1.0 112.466 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 15.0 pt -120.75 151.28 23.64 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.141 0 C-N-CA 124.644 1.177 . . . . 1.0 108.828 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -112.7 163.42 14.58 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 120.8 -1.188 . . . . 1.0 109.803 -169.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -70.19 -13.94 62.41 Favored 'General case' 0 N--CA 1.436 -1.142 0 O-C-N 119.726 -1.859 . . . . 1.0 112.895 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.0 m -84.55 -11.84 55.27 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 125.948 1.699 . . . . 1.0 112.164 171.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -83.43 173.19 11.72 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.449 -2.032 . . . . 1.0 110.721 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 76.9 p -153.48 159.23 32.38 Favored Pre-proline 0 CA--C 1.498 -1.055 0 O-C-N 120.748 -1.22 . . . . 1.0 111.027 -161.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.87 -32.27 95.05 Favored 'Trans proline' 0 N--CA 1.44 -1.626 0 C-N-CA 123.616 2.877 . . . . 1.0 115.17 171.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.29 -46.03 78.37 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-O 122.54 1.162 . . . . 1.0 113.59 175.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -69.58 -40.77 76.53 Favored 'General case' 0 N--CA 1.433 -1.284 0 C-N-CA 125.424 1.49 . . . . 1.0 113.452 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 16.4 tp -87.74 -8.4 56.09 Favored 'General case' 0 N--CA 1.435 -1.208 0 O-C-N 120.811 -1.18 . . . . 1.0 111.696 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 60.13 48.25 8.59 Favored 'General case' 0 N--CA 1.434 -1.228 0 C-N-CA 127.5 2.32 . . . . 1.0 114.443 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.66 151.29 25.25 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 127.169 2.188 . . . . 1.0 115.081 174.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -105.6 175.95 5.32 Favored 'General case' 0 N--CA 1.433 -1.296 0 C-N-CA 126.089 1.756 . . . . 1.0 110.518 -175.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -56.26 -26.59 52.18 Favored 'General case' 0 N--CA 1.435 -1.216 0 C-N-CA 126.297 1.839 . . . . 1.0 115.528 176.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -139.73 89.69 2.34 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 124.438 1.095 . . . . 1.0 108.826 163.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.86 169.68 12.33 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 120.187 -1.57 . . . . 1.0 114.283 174.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.9 m -130.84 118.07 20.25 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 124.809 1.243 . . . . 1.0 111.012 177.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 24.2 mm -105.74 140.56 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.191 0 C-N-CA 127.575 2.35 . . . . 1.0 107.981 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -110.98 142.58 42.92 Favored 'General case' 0 N--CA 1.433 -1.285 0 O-C-N 120.445 -1.409 . . . . 1.0 109.2 -174.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.5 139.64 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.198 0 O-C-N 120.494 -1.379 . . . . 1.0 109.297 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -123.71 140.67 52.76 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 107.714 -1.217 . . . . 1.0 107.714 165.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -86.03 133.12 33.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 120.966 -1.084 . . . . 1.0 109.893 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -139.24 151.46 46.53 Favored 'General case' 0 N--CA 1.434 -1.236 0 O-C-N 120.939 -1.101 . . . . 1.0 112.532 -163.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -117.89 146.19 44.1 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 125.069 1.348 . . . . 1.0 108.472 176.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.7 t -56.18 145.15 27.15 Favored 'General case' 0 N--CA 1.438 -1.059 0 C-N-CA 125.024 1.33 . . . . 1.0 113.996 173.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -98.78 -2.04 57.36 Favored Glycine 0 CA--C 1.493 -1.341 0 O-C-N 120.588 -1.32 . . . . 1.0 113.326 177.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.733 0 CA-C-N 118.003 0.901 . . . . 1.0 111.52 -179.233 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.891 0 N-CA-C 115.276 0.871 . . . . 1.0 115.276 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . 0.418 ' HB ' ' O ' ' A' ' 31' ' ' GLN . 42.0 t -97.16 -69.28 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.189 0 CA-C-O 123.765 1.745 . . . . 1.0 110.836 173.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . 0.56 HG21 ' CD2' ' A' ' 32' ' ' PHE . 2.3 mt -113.12 118.43 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 C-N-CA 127.811 2.444 . . . . 1.0 111.432 -167.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -102.12 114.24 28.2 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 120.021 -1.674 . . . . 1.0 109.19 169.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.21 141.51 39.85 Favored 'General case' 0 CA--C 1.497 -1.07 0 CA-C-N 121.725 2.057 . . . . 1.0 115.476 -175.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 58.5 p -106.32 -10.88 16.19 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 125.488 1.515 . . . . 1.0 111.717 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -59.46 137.14 58.11 Favored 'General case' 0 N--CA 1.435 -1.184 0 C-N-CA 126.727 2.011 . . . . 1.0 113.183 171.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 42.1 t0 78.87 107.63 0.07 Allowed 'General case' 0 N--CA 1.435 -1.211 0 C-N-CA 128.348 2.659 . . . . 1.0 107.327 -167.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -90.02 36.09 0.86 Allowed 'General case' 0 N--CA 1.435 -1.21 0 O-C-N 119.946 -1.721 . . . . 1.0 114.387 -154.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -76.94 72.26 3.5 Favored 'General case' 0 N--CA 1.435 -1.199 0 C-N-CA 126.171 1.789 . . . . 1.0 110.177 162.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 C--O 1.26 1.639 0 C-N-CA 126.559 1.944 . . . . 1.0 115.815 -166.772 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.1 tpt . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 113.426 0.899 . . . . 1.0 113.426 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.24 -43.13 87.47 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 115.482 1.66 . . . . 1.0 115.482 -175.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -116.86 109.32 16.92 Favored 'General case' 0 N--CA 1.433 -1.29 0 O-C-N 120.964 -1.085 . . . . 1.0 109.286 -178.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -154.26 158.13 39.76 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 108.504 -0.924 . . . . 1.0 108.504 173.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -93.57 126.06 51.43 Favored Pre-proline 0 N--CA 1.435 -1.215 0 CA-C-O 117.815 -1.088 . . . . 1.0 109.994 173.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -49.54 134.22 32.59 Favored 'Trans proline' 0 N--CA 1.442 -1.54 0 C-N-CA 124.363 3.375 . . . . 1.0 117.111 171.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.63 -36.82 43.48 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 115.027 1.491 . . . . 1.0 115.027 -179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 62.85 27.47 16.03 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 117.257 2.318 . . . . 1.0 117.257 167.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 78.19 2.74 84.05 Favored Glycine 0 CA--C 1.493 -1.321 0 O-C-N 120.096 -1.627 . . . . 1.0 114.241 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.2 m -124.94 22.98 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.216 0 C-N-CA 125.27 1.428 . . . . 1.0 109.879 -173.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.68 146.35 0.07 Allowed 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 119.061 2.985 . . . . 1.0 119.061 177.192 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.7 p -74.05 163.76 27.48 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 115.231 1.567 . . . . 1.0 115.231 -173.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -142.5 -7.28 0.88 Allowed 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 113.56 0.948 . . . . 1.0 113.56 179.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -112.88 139.56 48.41 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.685 -1.259 . . . . 1.0 110.953 -178.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -106.71 138.23 43.27 Favored 'General case' 0 N--CA 1.436 -1.136 0 O-C-N 120.546 -1.346 . . . . 1.0 111.799 -171.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.4 p-10 -160.19 175.59 12.73 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.411 2.285 . . . . 1.0 105.947 175.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.2 p-80 -58.77 163.25 3.45 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 118.602 2.816 . . . . 1.0 118.602 176.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 pt -139.39 160.78 28.28 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.279 0 C-N-CA 129.43 3.092 . . . . 1.0 107.297 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -111.94 144.86 40.58 Favored 'General case' 0 N--CA 1.435 -1.2 0 O-C-N 119.844 -1.785 . . . . 1.0 109.926 165.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.15 156.69 46.94 Favored 'General case' 0 N--CA 1.433 -1.283 0 O-C-N 119.361 -2.087 . . . . 1.0 107.071 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.0 ptpt -125.37 150.67 47.0 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 126.363 1.865 . . . . 1.0 112.833 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -117.55 124.82 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.17 0 C-N-CA 125.295 1.438 . . . . 1.0 107.88 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -124.9 130.19 51.87 Favored 'General case' 0 N--CA 1.434 -1.268 0 CA-C-O 122.613 1.196 . . . . 1.0 113.418 -176.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -87.66 -177.16 48.22 Favored Glycine 0 N--CA 1.435 -1.386 0 C-N-CA 124.823 1.201 . . . . 1.0 113.349 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -75.68 -15.62 60.29 Favored 'General case' 0 N--CA 1.435 -1.193 0 O-C-N 120.915 -1.344 . . . . 1.0 113.168 -177.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.9 p-10 -90.93 0.38 57.52 Favored 'General case' 0 N--CA 1.433 -1.293 0 C-N-CA 125.101 1.36 . . . . 1.0 111.577 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 82.57 0.16 89.75 Favored Glycine 0 CA--C 1.493 -1.331 0 C-N-CA 126.088 1.804 . . . . 1.0 113.668 179.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.4 m -70.67 128.12 35.0 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 124.936 1.295 . . . . 1.0 111.021 177.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.5 p -139.85 132.05 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.179 0 O-C-N 121.462 -0.774 . . . . 1.0 111.973 -166.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -129.17 138.72 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.091 0 O-C-N 120.619 -1.301 . . . . 1.0 109.923 176.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.75 146.56 46.92 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 124.025 1.869 . . . . 1.0 114.619 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.61 146.39 47.86 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.857 -1.777 . . . . 1.0 107.952 -163.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.255 37.5 ttpt -112.04 115.76 29.44 Favored 'General case' 0 CA--C 1.494 -1.188 0 O-C-N 120.482 -1.386 . . . . 1.0 111.822 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 13.5 tt -147.98 154.58 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.337 0 CA-C-O 124.24 1.971 . . . . 1.0 110.972 -160.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.31 158.97 19.55 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.608 -2.087 . . . . 1.0 112.625 -176.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ttt-85 -71.31 -38.02 71.77 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 115.817 1.784 . . . . 1.0 115.817 -161.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -91.06 -16.61 27.6 Favored 'General case' 0 N--CA 1.435 -1.212 0 O-C-N 120.769 -1.207 . . . . 1.0 113.571 -178.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 63.8 m -63.37 138.18 97.28 Favored Pre-proline 0 N--CA 1.437 -1.117 0 C-N-CA 125.331 1.452 . . . . 1.0 112.566 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -65.74 156.27 64.85 Favored 'Trans proline' 0 N--CA 1.44 -1.66 0 CA-C-N 124.023 2.473 . . . . 1.0 116.306 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . 0.422 1.8 pp -61.39 -25.62 67.3 Favored 'General case' 0 N--CA 1.434 -1.267 0 C-N-CA 126.317 1.847 . . . . 1.0 114.006 172.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 93.2 p -52.58 -29.02 23.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 O-C-N 119.944 -1.722 . . . . 1.0 114.879 170.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -42.66 77.4 Favored 'General case' 0 N--CA 1.433 -1.277 0 O-C-N 119.5 -2.0 . . . . 1.0 112.73 -174.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.14 -35.44 80.48 Favored 'General case' 0 N--CA 1.435 -1.211 0 O-C-N 120.362 -1.461 . . . . 1.0 113.208 170.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.9 ttt -61.42 -41.75 97.66 Favored 'General case' 0 N--CA 1.435 -1.19 0 O-C-N 120.193 -1.567 . . . . 1.0 114.805 173.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.96 -43.03 99.69 Favored 'General case' 0 N--CA 1.435 -1.183 0 C-N-CA 125.761 1.624 . . . . 1.0 111.989 172.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.73 81.95 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 174.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -59.79 -43.42 94.44 Favored 'General case' 0 N--CA 1.437 -1.112 0 C-N-CA 126.213 1.805 . . . . 1.0 111.662 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.5 m -60.39 -43.41 96.68 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 125.249 1.419 . . . . 1.0 114.174 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -66.75 -51.55 54.52 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 114.99 1.478 . . . . 1.0 114.99 174.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -42.29 59.3 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.761 -1.212 . . . . 1.0 113.749 -172.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -112.33 0.47 15.7 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 113.053 0.76 . . . . 1.0 113.053 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.78 41.46 28.52 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 118.093 1.997 . . . . 1.0 118.093 163.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.4 mt -121.58 168.02 12.22 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 125.282 1.433 . . . . 1.0 111.215 -171.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 t -102.22 133.04 47.74 Favored 'General case' 0 N--CA 1.436 -1.149 0 O-C-N 120.502 -1.374 . . . . 1.0 112.927 176.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 23.8 ptp -66.55 -18.57 65.43 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 115.397 1.628 . . . . 1.0 115.397 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -96.59 1.52 51.33 Favored 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 120.613 -1.304 . . . . 1.0 113.061 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -110.37 -31.5 7.27 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 119.722 -1.861 . . . . 1.0 111.769 177.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.2 pp -115.27 135.25 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 O-C-N 121.615 -0.678 . . . . 1.0 110.661 170.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mmm180 -132.75 154.93 49.74 Favored 'General case' 0 N--CA 1.436 -1.163 0 O-C-N 120.137 -1.602 . . . . 1.0 111.329 -171.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.425 ' HB3' HD11 ' A' ' 67' ' ' ILE . 16.9 m-30 -104.17 148.66 26.04 Favored 'General case' 0 N--CA 1.435 -1.195 0 O-C-N 120.297 -1.502 . . . . 1.0 113.055 -166.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -147.34 145.1 29.2 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 125.079 1.352 . . . . 1.0 108.213 -171.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -129.97 110.29 11.55 Favored 'General case' 0 N--CA 1.435 -1.219 0 O-C-N 120.615 -1.303 . . . . 1.0 109.026 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 52.57 47.15 25.31 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 126.757 2.023 . . . . 1.0 114.038 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.93 4.89 86.39 Favored Glycine 0 N--CA 1.435 -1.416 0 O-C-N 120.371 -1.456 . . . . 1.0 116.289 -176.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -114.6 132.2 22.99 Favored Pre-proline 0 N--CA 1.434 -1.238 0 CA-C-N 120.386 2.093 . . . . 1.0 109.08 -177.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.63 135.26 34.05 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 123.869 3.046 . . . . 1.0 115.797 163.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.425 HD11 ' HB3' ' A' ' 60' ' ' PHE . 4.7 pt -119.66 142.85 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 105.943 -1.873 . . . . 1.0 105.943 174.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -100.14 158.25 15.99 Favored 'General case' 0 CA--C 1.494 -1.209 0 O-C-N 120.796 -1.19 . . . . 1.0 108.574 -169.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -66.12 -26.0 67.25 Favored 'General case' 0 N--CA 1.436 -1.173 0 O-C-N 119.382 -2.074 . . . . 1.0 113.569 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.3 m -78.48 -12.63 60.02 Favored 'General case' 0 N--CA 1.436 -1.16 0 C-N-CA 126.215 1.806 . . . . 1.0 113.213 171.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -74.94 172.64 11.9 Favored 'General case' 0 N--CA 1.432 -1.343 0 O-C-N 118.663 -2.523 . . . . 1.0 111.711 174.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 54.4 p -148.11 160.83 36.39 Favored Pre-proline 0 CA--C 1.495 -1.143 0 O-C-N 120.094 -1.629 . . . . 1.0 109.24 -159.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 99.7 Cg_exo -55.83 -36.14 94.9 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 123.275 2.65 . . . . 1.0 115.909 164.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.45 -45.7 82.72 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 114.124 1.157 . . . . 1.0 114.124 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -71.66 -43.16 66.55 Favored 'General case' 0 N--CA 1.433 -1.299 0 C-N-CA 124.694 1.197 . . . . 1.0 111.886 -177.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -4.56 56.41 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.81 0.814 . . . . 1.0 111.754 -175.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . 0.267 51.2 mt-10 60.02 48.33 8.75 Favored 'General case' 0 N--CA 1.436 -1.147 0 C-N-CA 127.129 2.172 . . . . 1.0 115.106 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 55.9 mtt -73.64 153.6 40.08 Favored 'General case' 0 N--CA 1.432 -1.335 0 C-N-CA 126.653 1.981 . . . . 1.0 111.675 173.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.579 ' HG3' ' H ' ' A' ' 81' ' ' GLU . 10.7 pt-20 -118.14 178.7 4.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 O-C-N 120.568 -1.333 . . . . 1.0 110.606 -168.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . 0.259 9.6 p-10 -52.92 -26.55 15.35 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 127.987 2.515 . . . . 1.0 116.556 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.579 ' H ' ' HG3' ' A' ' 79' ' ' GLU . 50.9 mt-10 -136.61 66.32 1.48 Allowed 'General case' 0 N--CA 1.435 -1.18 0 C-N-CA 125.12 1.368 . . . . 1.0 111.854 167.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.73 167.35 19.22 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 116.966 2.21 . . . . 1.0 116.966 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 86.4 m -127.63 125.38 40.07 Favored 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 126.17 1.788 . . . . 1.0 112.121 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 73.9 mt -114.33 140.76 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 C-N-CA 129.233 3.013 . . . . 1.0 109.172 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -110.9 141.48 44.26 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 125.965 1.706 . . . . 1.0 106.597 -171.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.7 t -108.54 131.6 58.68 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.257 0 O-C-N 120.783 -1.198 . . . . 1.0 108.82 -176.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -118.46 135.31 54.44 Favored 'General case' 0 N--CA 1.434 -1.241 0 CA-C-O 123.456 1.598 . . . . 1.0 111.822 164.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -89.14 140.5 29.4 Favored 'General case' 0 N--CA 1.432 -1.342 0 C-N-CA 125.414 1.486 . . . . 1.0 111.816 -172.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 -121.08 3.96 10.42 Favored 'General case' 0 N--CA 1.435 -1.222 0 O-C-N 121.077 -1.014 . . . . 1.0 111.67 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -56.66 -45.12 81.86 Favored 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 126.521 1.928 . . . . 1.0 115.772 -175.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 34.7 p -99.24 -3.85 33.3 Favored 'General case' 0 N--CA 1.436 -1.153 0 O-C-N 120.525 -1.36 . . . . 1.0 111.607 -175.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 63.26 -179.15 5.94 Favored Glycine 0 N--CA 1.435 -1.382 0 C-N-CA 125.964 1.745 . . . . 1.0 116.74 -177.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.749 0 O-C-N 120.717 -1.461 . . . . 1.0 109.673 -177.126 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 965' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.937 0 CA-C-O 120.256 -0.191 . . . . 1.0 113.442 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 966' ' ' VAL . . . . . . . . . . . . 0.292 0.2 OUTLIER -74.92 -50.28 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.222 0 N-CA-C 116.381 1.993 . . . . 1.0 116.381 -166.482 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 967' ' ' ILE . . . . . . . . . . . . . 5.5 mt -113.05 115.22 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.081 0 C-N-CA 124.573 1.149 . . . . 1.0 109.276 -168.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 968' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -102.16 122.94 45.13 Favored 'General case' 0 N--CA 1.434 -1.237 0 O-C-N 120.139 -1.6 . . . . 1.0 110.364 178.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 969' ' ' LEU . . . . . 0.415 ' HA ' HD13 ' B' ' 969' ' ' LEU . 3.2 mm? -91.96 140.96 29.15 Favored 'General case' 0 N--CA 1.435 -1.182 0 O-C-N 120.167 -1.583 . . . . 1.0 114.989 -175.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 970' ' ' THR . . . . . . . . . . . . . 23.2 m -122.64 131.56 53.87 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 105.531 -2.026 . . . . 1.0 105.531 165.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 971' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.47 168.75 24.43 Favored 'General case' 0 N--CA 1.436 -1.171 0 O-C-N 120.884 -1.135 . . . . 1.0 109.782 -174.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 972' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.43 -43.48 90.31 Favored 'General case' 0 N--CA 1.434 -1.272 0 C-N-CA 125.87 1.668 . . . . 1.0 115.182 -168.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 973' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -61.56 140.43 58.12 Favored 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 125.801 1.64 . . . . 1.0 113.658 -173.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 974' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -58.09 134.47 56.47 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 114.276 1.213 . . . . 1.0 114.276 174.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 975' ' ' GLU . . . . . . . . . . . . 0.272 40.3 tt0 . . . . . 0 C--O 1.262 1.743 0 N-CA-C 115.121 1.526 . . . . 1.0 115.121 174.617 . . . . . . . . 1 1 . 1 stop_ save_